
 OPTIM version Unversioned directory, Copyright (C) David J. Wales
 OPTIM comes with ABSOLUTELY NO WARRANTY; for details supply WARRANTY as an input keyword.
 This is free software, and you are welcome to redistribute it
 under certain conditions; provide keyword COPYRIGHT to see the details.

getparams> OPTIM is running on host name
cpu-0-0
 getparams> Number of atoms (or variables)  determined as     15
 getparams> Number of optimisation degrees of freedom     45
 keyword> WARNING *** no congeom file found. Will use end point minima only.
 keywords> QCI image density=     50.00000000     maximum images=         1
 keywords> Adjusting QCI spring constant every          5 steps by factor      1.010000000     for spacing deviation      12.00000000    % min/max=     1.0000         3.0000    
 keyword> DNEB for distance <    0.00 and after      200 cycles
 orca_init> Using ORCA subprocesses
 orca_init> Using ORCA subprocesses
 orca_init> ORCAMPI specified. Assuming ORCA will run in parallel and the respective
            "%PAL NPROCS x END" command is present in ORCA.template.
            Make sure the entire ORCA path is specified in your input.
            Also ensure you have enough cores (x) and memory available!
            An OpenMPI instruction will be added to the ORCA call.
 fetchz> Hybrid EF/BFGS transition state search, maximum steps=  2000
         maximum tangent space steps=   4 or   10 when overlap is better than     0.999900
 fetchz> Initial maximum for EF uphill step=     0.02000000
 fetchz> Maximum value for maximum allowed EF uphill steps=     0.03000000
 fetchz> Minimum value for maximum allowed EF uphill steps=     0.00500000
 fetchz> Uphill mode is    0 for initial step and    0 after that
 fetchz> No Hessian: Rayleigh-Ritz max steps=1000 RMS <       0.0100 and |% change|<    0.10E-02
 fetchz> Hessian eigenvector in Rayleigh-Ritz scheme calculated using method    2

 fetchz> Coordinates of second point read from file finish

 fetchz> Point group checked when RMS force <     0.00100000, highest symmetry axis tested for=  6
 fetchz> Initial distance and eigenvalue tolerances in symmetry determination=     0.00010000     0.00010000
 fetchz> Minimum number of optimization steps=    50
 fetchz> Using QCI potential for initial interpolation in each cycle
         with absolute distance change tolerance         0.00100
         extra distance before turning on constraint potential         0.20000 after switch         0.05000
         constraint spring constant=        1.00000
         image distance spring constant=        3.00000
         repulsion factor between unconstrained atoms=        1.00000
         repulsion cutoff will be the minimum of         9.00000 and the shortest distance in the end points
         fraction for restoring true potential=        0.00000
         maximum separation of atoms in sequence for constraint=    15
         minimum separation of atoms in sequence for repulsion=     0
         maximum optimization steps for constrained potential=  300000
         initial # images for constrained potential, maximum, check interval=                   3                   1          2147483647
         number of interpolation attempts and initial image increment=       1       0
         RMS gradient per image tolerance for constrained potential=     1.500000000    
         maximum optimization steps for constrained/real potential=    1000
         maximum steps for relaxation after adding a new atom before backtrack=  400000
         maximum number of constraints per atom=    10
         maximum energy per image for convergence during constraint potential phase=     1.000000000    
         interval for checking repulsive interactions=   100
         multiple of cutoff for repulsion neighbour list=        1.2500000000
         not adding terms for constraint internal minima
         Minimum and Maximum image separations:        -1.00000***************
 fetchz> Pathways will be calculated saving    100 frames on each side
 fetchz> Convergence criterion for LBFGS optimization: RMS force< 0.10000000E-04 maximum steps=    3000
 fetchz> Maximum energy rise in LBFGS minimization=    0.1000000000E-04
 fetchz> Number of updates in LBFGS=       50
 fetchz> Number of updates in XLBFGS=  50
 fetchz> Number of updates in mind=   5
 fetchz> Number of updates in qci=   4
 fetchz> Initial guess for diagonal elements in LBFGS=     0.1000
 fetchz> Initial guess for diagonal elements in XLBFGS=    0.1000
 fetchz> Maximum step size in LBFGS energy minimization=     0.0200
 fetchz> Maximum step size in XLBFGS=    0.1000
 fetchz> Maximum step size in LBFGS neb image minimization=                 0.2000
 fetchz> Warnings will be issued if atoms become closer than 0.5 units
 fetchz> pushoff from ts determined by golden section search in the range zero to +/-     0.1000000000    
         Maximum golden ratio iterations        100 step size convergence     0.1000000000E-02
 fetchz> System will be enclosed in a spherical container radius=     2000.00000


 OPTIM> Using translational/rotational ev shift=     1000000.000    
 OPTIM> Initial energy=    -273.6151510     RMS force=    0.8853007100E-05
 OPTIM> Final energy  =    -273.6072755     RMS force=    0.7337742230E-05
 minpermdist> initial energy for structure A=                  -273.607275544918025 RMS=        0.000007337475159
 minpermdist> initial energy for structure B=                  -273.615151023675992 RMS=        0.000008853443037
 KeyConnect> Maximum cycles = 30, maximum images = 3
 KeyConnect> Maximum attempts per pair of minima = 1, with increment image density of 1.00
 KeyConnect> Image density = 15.00, iteration density = 15.00
 KeyNEB> Initial and final NEB force constants     10.00000000        10.00000000     factor=    1.000000000    
 KeyNEB> Number of images will vary depending on the separation of the endpoints
 KeyNEB> NEB coordinates will be saved to xyz file "neb.xyz" every 100 iterations
 KeyNEB> Energy profile will be saved to file "neb.EofS" every 100 iterations
 KeyNEB> Verbose printing is on
 KeyNEB> Evolution of AvDev, E, Rms and S will be saved to files "AvDevofI", "EofI", "RmsofI" and "SofI"
 KeyGrad> Overall rotation and translation will NOT be removed
 KeyGrad> Using doubly nudged elastic band gradient
 KeyOutput> Transition state candidates will be optimized
 KeyOutput> Verbose printing during transition states optimization
 KeyOutput> Transition state candidates are maxima along NEB
 KeyMin> Maximal number of iterations will vary, depending on the number of images in the band
 KeyMin> RMS convergence criterion is set to 0.0001
 KeyMin> L-BFGS minimization
 KeyLBFGS> Maximum step size per image =     0.2000000000    
 KeyLBFGS> 5 Hessian updates per iteration
 KeyLBFGS> Guess for inverse Hessian diagonal elements =     0.1000000000E-02
 KeyTau> Using Henkelman and Jonsson's improved tangent
 KeyConnect> Verbose printing is on
 KeyDecide> Cost function in Dijkstra algorithm is D^2

 >>>>>>>>>>>>>>>>>>>>> CONNECT CYCLE 1 >>>>>>>>>>>>>>>>>>>>> 2 minima and 0 ts are known >>>>>>>>>>>>>>>>>>>>
 decide> Shortest path in Dijkstra has      1 steps with      1 missing connections, weight=     5.9419    
 decide> The unconnected minima in the chain and their distances are:
     2        2.44     1 
 
 minpermdist> initial energy for structure A=                  -273.607272189012008 RMS=        0.000010913018510
 minpermdist> initial energy for structure B=                  -273.615151023684007 RMS=        0.000008853293239

 tryconnect> Interpolation for minima 1_S and 2_F using 1 initial images  (interp attempt set to #1)  ...
 intlbfgs> extra distance before turning on constraint potential is initially     0.200000
intlbfgs> Allocating and intialising atomstores
 intlbfgs> End minima distance=     2.437597494     density      50.00000000     images set to                    1
 intlbfgs> Maximum number of steps for constraint potential phase is 300000
 intlbfgs> Updates:      4 maximum step size=    0.2000000000    
 intlbfgs> Total number of atoms moving less than threshold=     0
 intlbfgs> Total distance constraints=     5 shortest=        1.01364 longest=        1.08965
 checkperc> steps to atom 1 converged in        0 cycles; maximum=       0 disconnected=      14
 checkperc> increasing the local constraint tolerance parameter to         0.00110
 intlbfgs> Total distance constraints=     5 shortest=        1.01364 longest=        1.08965
 checkperc> steps to atom 1 converged in        0 cycles; maximum=       0 disconnected=      14
 checkperc> increasing the local constraint tolerance parameter to         0.00121
 intlbfgs> Total distance constraints=     6 shortest=        1.01364 longest=        3.17579
 checkperc> steps to atom 1 converged in        0 cycles; maximum=       0 disconnected=      14
 checkperc> increasing the local constraint tolerance parameter to         0.00133
 intlbfgs> Total distance constraints=     8 shortest=        1.01364 longest=        3.17579
 checkperc> steps to atom 1 converged in        0 cycles; maximum=       0 disconnected=      14
 checkperc> increasing the local constraint tolerance parameter to         0.00146
 intlbfgs> Total distance constraints=     8 shortest=        1.01364 longest=        3.17579
 checkperc> steps to atom 1 converged in        0 cycles; maximum=       0 disconnected=      14
 checkperc> increasing the local constraint tolerance parameter to         0.00161
 intlbfgs> Total distance constraints=     9 shortest=        1.01364 longest=        3.17579
 checkperc> steps to atom 1 converged in        0 cycles; maximum=       0 disconnected=      14
 checkperc> increasing the local constraint tolerance parameter to         0.00177
 intlbfgs> Total distance constraints=     9 shortest=        1.01364 longest=        3.17579
 checkperc> steps to atom 1 converged in        0 cycles; maximum=       0 disconnected=      14
 checkperc> increasing the local constraint tolerance parameter to         0.00195
 intlbfgs> Total distance constraints=     9 shortest=        1.01364 longest=        3.17579
 checkperc> steps to atom 1 converged in        0 cycles; maximum=       0 disconnected=      14
 checkperc> increasing the local constraint tolerance parameter to         0.00214
 intlbfgs> Total distance constraints=     9 shortest=        1.01364 longest=        3.17579
 checkperc> steps to atom 1 converged in        0 cycles; maximum=       0 disconnected=      14
 checkperc> increasing the local constraint tolerance parameter to         0.00236
 intlbfgs> Total distance constraints=     9 shortest=        1.01364 longest=        3.17579
 checkperc> steps to atom 1 converged in        0 cycles; maximum=       0 disconnected=      14
 checkperc> increasing the local constraint tolerance parameter to         0.00259
 intlbfgs> Total distance constraints=     9 shortest=        1.01364 longest=        3.17579
 checkperc> steps to atom 1 converged in        0 cycles; maximum=       0 disconnected=      14
 checkperc> increasing the local constraint tolerance parameter to         0.00285
 intlbfgs> Total distance constraints=     9 shortest=        1.01364 longest=        3.17579
 checkperc> steps to atom 1 converged in        0 cycles; maximum=       0 disconnected=      14
 checkperc> increasing the local constraint tolerance parameter to         0.00314
 intlbfgs> Total distance constraints=     9 shortest=        1.01364 longest=        3.17579
 checkperc> steps to atom 1 converged in        0 cycles; maximum=       0 disconnected=      14
 checkperc> increasing the local constraint tolerance parameter to         0.00345
 intlbfgs> Total distance constraints=     9 shortest=        1.01364 longest=        3.17579
 checkperc> steps to atom 1 converged in        0 cycles; maximum=       0 disconnected=      14
 checkperc> increasing the local constraint tolerance parameter to         0.00380
 intlbfgs> Total distance constraints=     9 shortest=        1.01364 longest=        3.17579
 checkperc> steps to atom 1 converged in        0 cycles; maximum=       0 disconnected=      14
 checkperc> increasing the local constraint tolerance parameter to         0.00418
 intlbfgs> Total distance constraints=     9 shortest=        1.01364 longest=        3.17579
 checkperc> steps to atom 1 converged in        0 cycles; maximum=       0 disconnected=      14
 checkperc> increasing the local constraint tolerance parameter to         0.00459
 intlbfgs> Total distance constraints=     9 shortest=        1.01364 longest=        3.17579
 checkperc> steps to atom 1 converged in        0 cycles; maximum=       0 disconnected=      14
 checkperc> increasing the local constraint tolerance parameter to         0.00505
 intlbfgs> Total distance constraints=     9 shortest=        1.01364 longest=        3.17579
 checkperc> steps to atom 1 converged in        0 cycles; maximum=       0 disconnected=      14
 checkperc> increasing the local constraint tolerance parameter to         0.00556
 intlbfgs> Total distance constraints=    10 shortest=        1.01364 longest=        3.77571
 checkperc> steps to atom 1 converged in        0 cycles; maximum=       0 disconnected=      14
 checkperc> increasing the local constraint tolerance parameter to         0.00612
 intlbfgs> Total distance constraints=    10 shortest=        1.01364 longest=        3.77571
 checkperc> steps to atom 1 converged in        0 cycles; maximum=       0 disconnected=      14
 checkperc> increasing the local constraint tolerance parameter to         0.00673
 intlbfgs> Total distance constraints=    12 shortest=        1.01364 longest=        3.77571
 checkperc> steps to atom 1 converged in        1 cycles; maximum=       2 disconnected=      11
 checkperc> increasing the local constraint tolerance parameter to         0.00740
 intlbfgs> Total distance constraints=    14 shortest=        1.01364 longest=        3.77571
 checkperc> steps to atom 1 converged in        1 cycles; maximum=       2 disconnected=      11
 checkperc> increasing the local constraint tolerance parameter to         0.00814
 intlbfgs> Total distance constraints=    14 shortest=        1.01364 longest=        3.77571
 checkperc> steps to atom 1 converged in        1 cycles; maximum=       2 disconnected=      11
 checkperc> increasing the local constraint tolerance parameter to         0.00895
 intlbfgs> Total distance constraints=    14 shortest=        1.01364 longest=        3.77571
 checkperc> steps to atom 1 converged in        1 cycles; maximum=       2 disconnected=      11
 checkperc> increasing the local constraint tolerance parameter to         0.00985
 intlbfgs> Total distance constraints=    15 shortest=        1.01364 longest=        3.77571
 checkperc> steps to atom 1 converged in        1 cycles; maximum=       2 disconnected=      11
 checkperc> increasing the local constraint tolerance parameter to         0.01083
 intlbfgs> Total distance constraints=    18 shortest=        1.01364 longest=        4.77820
 checkperc> steps to atom 1 converged in        1 cycles; maximum=       2 disconnected=      11
 checkperc> increasing the local constraint tolerance parameter to         0.01192
 intlbfgs> Total distance constraints=    18 shortest=        1.01364 longest=        4.77820
 checkperc> steps to atom 1 converged in        1 cycles; maximum=       2 disconnected=      11
 checkperc> increasing the local constraint tolerance parameter to         0.01311
 intlbfgs> Total distance constraints=    19 shortest=        1.01364 longest=        4.77820
 checkperc> steps to atom 1 converged in        1 cycles; maximum=       2 disconnected=      11
 checkperc> increasing the local constraint tolerance parameter to         0.01442
 intlbfgs> Total distance constraints=    20 shortest=        1.01364 longest=        4.77820
 checkperc> steps to atom 1 converged in        3 cycles; maximum=       5 disconnected=       2
 checkperc> increasing the local constraint tolerance parameter to         0.01586
 intlbfgs> Total distance constraints=    22 shortest=        1.01364 longest=        4.77820
 checkperc> steps to atom 1 converged in        3 cycles; maximum=       5 disconnected=       2
 checkperc> increasing the local constraint tolerance parameter to         0.01745
 intlbfgs> Total distance constraints=    23 shortest=        1.01364 longest=        4.77820
 checkperc> steps to atom 1 converged in        3 cycles; maximum=       5 disconnected=       2
 checkperc> increasing the local constraint tolerance parameter to         0.01919
 intlbfgs> Total distance constraints=    24 shortest=        1.01364 longest=        4.77820
 checkperc> steps to atom 1 converged in        3 cycles; maximum=       5 disconnected=       2
 checkperc> increasing the local constraint tolerance parameter to         0.02111
 intlbfgs> Total distance constraints=    24 shortest=        1.01364 longest=        4.77820
 checkperc> steps to atom 1 converged in        3 cycles; maximum=       5 disconnected=       2
 checkperc> increasing the local constraint tolerance parameter to         0.02323
 intlbfgs> Total distance constraints=    25 shortest=        1.01364 longest=        4.77820
 checkperc> steps to atom 1 converged in        3 cycles; maximum=       5 disconnected=       2
 checkperc> increasing the local constraint tolerance parameter to         0.02555
 intlbfgs> Total distance constraints=    25 shortest=        1.01364 longest=        4.77820
 checkperc> steps to atom 1 converged in        3 cycles; maximum=       5 disconnected=       2
 checkperc> increasing the local constraint tolerance parameter to         0.02810
 intlbfgs> Total distance constraints=    26 shortest=        1.01364 longest=        4.77820
 checkperc> steps to atom 1 converged in        3 cycles; maximum=       5 disconnected=       2
 checkperc> increasing the local constraint tolerance parameter to         0.03091
 intlbfgs> Total distance constraints=    26 shortest=        1.01364 longest=        4.77820
 checkperc> steps to atom 1 converged in        3 cycles; maximum=       5 disconnected=       2
 checkperc> increasing the local constraint tolerance parameter to         0.03400
 intlbfgs> Total distance constraints=    27 shortest=        1.01364 longest=        4.77820
 checkperc> steps to atom 1 converged in        3 cycles; maximum=       5 disconnected=       2
 checkperc> increasing the local constraint tolerance parameter to         0.03740
 intlbfgs> Total distance constraints=    28 shortest=        1.01364 longest=        4.77820
 checkperc> steps to atom 1 converged in        3 cycles; maximum=       5 disconnected=       2
 checkperc> increasing the local constraint tolerance parameter to         0.04114
 intlbfgs> Total distance constraints=    28 shortest=        1.01364 longest=        4.77820
 checkperc> steps to atom 1 converged in        3 cycles; maximum=       5 disconnected=       2
 checkperc> increasing the local constraint tolerance parameter to         0.04526
 intlbfgs> Total distance constraints=    28 shortest=        1.01364 longest=        4.77820
 checkperc> steps to atom 1 converged in        3 cycles; maximum=       5 disconnected=       2
 checkperc> increasing the local constraint tolerance parameter to         0.04979
 intlbfgs> Total distance constraints=    28 shortest=        1.01364 longest=        4.77820
 checkperc> steps to atom 1 converged in        3 cycles; maximum=       5 disconnected=       2
 checkperc> increasing the local constraint tolerance parameter to         0.05476
 intlbfgs> Total distance constraints=    28 shortest=        1.01364 longest=        4.77820
 checkperc> steps to atom 1 converged in        3 cycles; maximum=       5 disconnected=       2
 checkperc> increasing the local constraint tolerance parameter to         0.06024
 intlbfgs> Total distance constraints=    28 shortest=        1.01364 longest=        4.77820
 checkperc> steps to atom 1 converged in        3 cycles; maximum=       5 disconnected=       2
 checkperc> increasing the local constraint tolerance parameter to         0.06626
 intlbfgs> Total distance constraints=    28 shortest=        1.01364 longest=        4.77820
 checkperc> steps to atom 1 converged in        3 cycles; maximum=       5 disconnected=       2
 checkperc> increasing the local constraint tolerance parameter to         0.07289
 intlbfgs> Total distance constraints=    28 shortest=        1.01364 longest=        4.77820
 checkperc> steps to atom 1 converged in        3 cycles; maximum=       5 disconnected=       2
 checkperc> increasing the local constraint tolerance parameter to         0.08018
 intlbfgs> Total distance constraints=    29 shortest=        1.01364 longest=        4.77820
 checkperc> steps to atom 1 converged in        3 cycles; maximum=       5 disconnected=       2
 checkperc> increasing the local constraint tolerance parameter to         0.08820
 intlbfgs> Total distance constraints=    31 shortest=        1.01364 longest=        4.77820
 checkperc> steps to atom 1 converged in        4 cycles; maximum=       6 disconnected=       1
 checkperc> increasing the local constraint tolerance parameter to         0.09702
 intlbfgs> Total distance constraints=    32 shortest=        1.01364 longest=        4.77820
 checkperc> steps to atom 1 converged in        4 cycles; maximum=       6 disconnected=       1
 checkperc> increasing the local constraint tolerance parameter to         0.10672
 intlbfgs> Total distance constraints=    34 shortest=        1.01364 longest=        4.77820
 checkperc> steps to atom 1 converged in        3 cycles; maximum=       6 disconnected=       1
 checkperc> increasing the local constraint tolerance parameter to         0.11739
 intlbfgs> Total distance constraints=    37 shortest=        1.01364 longest=        4.81169
 checkperc> steps to atom 1 converged in        3 cycles; maximum=       5 disconnected=       1
 checkperc> increasing the local constraint tolerance parameter to         0.12913
 intlbfgs> Total distance constraints=    39 shortest=        1.01364 longest=        4.90562
 checkperc> steps to atom 1 converged in        3 cycles; maximum=       5 disconnected=       1
 checkperc> increasing the local constraint tolerance parameter to         0.14204
 intlbfgs> Total distance constraints=    39 shortest=        1.01364 longest=        4.90562
 checkperc> steps to atom 1 converged in        3 cycles; maximum=       5 disconnected=       1
 checkperc> increasing the local constraint tolerance parameter to         0.15625
 intlbfgs> Total distance constraints=    44 shortest=        1.01364 longest=        5.46551
 checkperc> steps to atom 1 converged in        3 cycles; maximum=       3 disconnected=       1
 checkperc> increasing the local constraint tolerance parameter to         0.17187
 intlbfgs> Total distance constraints=    47 shortest=        1.01364 longest=        5.46551
 checkperc> steps to atom 1 converged in        3 cycles; maximum=       4 disconnected=       0
           4
           5
           7
           9
 intlbfgs> maximum constraints      9 for atom      4
 intlbfgs> largest number of common constraint atoms for any group is:     -1
 intlbfgs> Smallest overall motion for constraint     26 atoms      6     9 distance=        0.42461
 intlbfgs> Largest overall motion for constraint       7 atoms      2    10 distance=        2.05481
 intlbfgs> Turning on constraint     26 for atoms      6     9
 intlbfgs> Number of active atoms is now      2
 intlbfgs> constrained potential finished, time=       0.0 number of repulsions=     0
 checkrep> number of active repulsions and total=       0       0
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.1522890166        0.2220446049E-13
 intlbfgs> largest atomic distance between images is     0.1242479290     for atom      6 and images      1     2 total images=     1
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.1522890166        0.2220446049E-13
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:      1   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.1884928530E-17         2     3
 intlbfgs> largest atomic distance between images is     0.1242479290     for atom      6 and images      2     3 total images=     1
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.1522890166        0.9992007222E-13
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:      2   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.1884928530E-14         2     3
 intlbfgs> Choosing new active atom       14 new constraints=       2 maximum constraints available and possible=       2       2 shortest constraint=        1.01442
 intlbfgs> New active atom     14 closest average distances in endpoints:
     6     9
 intlbfgs> sorted average distances:
   1.014       1.626    
 intlbfgs> New active atom is number     14 total=     3 steps=     3
 intlbfgs> New active atom     14 is constrained to      2 other active atoms:
     6     9
 intlbfgs> sorted distances:
   1.014       1.626    
 intlbfgs> Turning on constraint     30 for atoms      6    14
 intlbfgs> Turning on constraint     36 for atoms      9    14
 checkrep> number of active repulsions and total=       0       0
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.2517436038        0.1554312234E-12
 intlbfgs> energies for constrained, preserved, closest, and linear schemes=    0.10000+101    0.10000+101    0.10000+101     0.0000    
 intlbfgs> lowest energy from linear interpolation
 checkrep> number of active repulsions and total=       0       0
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.2517436038        0.1554312234E-12
 intlbfgs> largest atomic distance between images is     0.2004567221     for atom     14 and images      1     2 total images=     1
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.2517436038        0.2220446049E-13
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:      3   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.1923553586E-14         3     3
 intlbfgs> Choosing new active atom       15 new constraints=       3 maximum constraints available and possible=       3       3 shortest constraint=        1.01471
 intlbfgs> New active atom     15 closest average distances in endpoints:
     6     9    14
 intlbfgs> sorted average distances:
   1.015       1.628       1.629    
 intlbfgs> New active atom is number     15 total=     4 steps=     4
 intlbfgs> New active atom     15 is constrained to      3 other active atoms:
     6     9    14
 intlbfgs> sorted distances:
   1.015       1.628       1.629    
 intlbfgs> Turning on constraint     31 for atoms      6    15
 intlbfgs> Turning on constraint     37 for atoms      9    15
 intlbfgs> Turning on constraint     47 for atoms     14    15
 intlbfgs> initial guess from closest three constrained active atoms,      6     9    14
 checkrep> number of active repulsions and total=       0       0
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.3137115362         2.556798790    
 intlbfgs> energies for constrained, preserved, closest, and linear schemes=     0.0000        0.10000+101    0.10000+101    0.10000+101
 intlbfgs> interpolation using closest constraints
 checkrep> number of active repulsions and total=       0       0
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.3137115362         2.556798790    
 intlbfgs> largest atomic distance between images is     0.2004567221     for atom     14 and images      1     2 total images=     1
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.3129700070        0.7558309774E-01
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:      4   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.2368657362E-01         4     3
 intlbfgs> Mean deviation     0.7558309774E-01 Decreasing QCI force constant to      2.970297030    
 intlbfgs> Choosing new active atom       11 new constraints=       4 maximum constraints available and possible=       4       4 shortest constraint=        2.93470
 intlbfgs> New active atom     11 closest average distances in endpoints:
     9     6    15    14
 intlbfgs> sorted average distances:
   2.935       3.274       3.776       4.112    
 intlbfgs> New active atom is number     11 total=     5 steps=     5
 intlbfgs> New active atom     11 is constrained to      4 other active atoms:
     9     6    15    14
 intlbfgs> sorted distances:
   2.935       3.274       3.776       4.112    
 intlbfgs> Turning on constraint     33 for atoms      9    11
 intlbfgs> Turning on constraint     27 for atoms      6    11
 intlbfgs> Turning on constraint     41 for atoms     11    15
 intlbfgs> Turning on constraint     40 for atoms     11    14
 intlbfgs> initial guess from closest three constrained active atoms,      9     6    15
 checkrep> number of active repulsions and total=       0       0
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.4152050492         8.383024690    
 intlbfgs> energies for constrained, preserved, closest, and linear schemes=     0.0000        0.10000+101    0.10000+101    0.10000+101
 intlbfgs> interpolation using closest constraints
 checkrep> number of active repulsions and total=       0       0
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.4152050492         8.383024690    
 intlbfgs> largest atomic distance between images is     0.2004567221     for atom     14 and images      1     2 total images=     1
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.3655374901        0.1070879915    
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:      5   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.1980021100             5     3
 intlbfgs> Choosing new active atom        4 new constraints=       5 maximum constraints available and possible=       5       5 shortest constraint=        1.01428
 intlbfgs> New active atom      4 closest average distances in endpoints:
    11     9     6    15    14
 intlbfgs> sorted average distances:
   1.014       3.032       3.176       3.849       3.866    
 intlbfgs> New active atom is number      4 total=     6 steps=     6
 intlbfgs> New active atom      4 is constrained to      5 other active atoms:
    11     9     6    15    14
 intlbfgs> sorted distances:
   1.014       3.032       3.176       3.849       3.866    
 intlbfgs> Turning on constraint     19 for atoms      4    11
 intlbfgs> Turning on constraint     18 for atoms      4     9
 intlbfgs> Turning on constraint     17 for atoms      4     6
 intlbfgs> Turning on constraint     23 for atoms      4    15
 intlbfgs> Turning on constraint     22 for atoms      4    14
 intlbfgs> initial guess from closest three constrained active atoms,     11     9     6
 checkrep> number of active repulsions and total=       0       0
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.3925580475         2.197072575    
 intlbfgs> energies for constrained, preserved, closest, and linear schemes=     0.0000        0.10000+101    0.10000+101    0.10000+101
 intlbfgs> interpolation using closest constraints
 checkrep> number of active repulsions and total=       0       0
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.3925580475         2.197072575    
 intlbfgs> largest atomic distance between images is     0.2004567221     for atom     14 and images      1     2 total images=     1
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.3914613680         0.000000000    
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:      6   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.3056476635E-01         6     3
 intlbfgs> Choosing new active atom       12 new constraints=       6 maximum constraints available and possible=       6       6 shortest constraint=        1.01428
 intlbfgs> New active atom     12 closest average distances in endpoints:
     4    11     9     6    15    14
 intlbfgs> sorted average distances:
   1.014       1.622       4.035       4.106       4.732       4.778    
 intlbfgs> New active atom is number     12 total=     7 steps=     7
 intlbfgs> New active atom     12 is constrained to      6 other active atoms:
     4    11     9     6    15    14
 intlbfgs> sorted distances:
   1.014       1.622       4.035       4.106       4.732       4.778    
 intlbfgs> Turning on constraint     20 for atoms      4    12
 intlbfgs> Turning on constraint     38 for atoms     11    12
 intlbfgs> Turning on constraint     34 for atoms      9    12
 intlbfgs> Turning on constraint     28 for atoms      6    12
 intlbfgs> Turning on constraint     44 for atoms     12    15
 intlbfgs> Turning on constraint     43 for atoms     12    14
 intlbfgs> initial guess from closest three constrained active atoms,      4    11     9
 checkrep> number of active repulsions and total=       0       0
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.4201981994         4.399852474    
 intlbfgs> energies for constrained, preserved, closest, and linear schemes=     0.0000        0.10000+101    0.10000+101    0.10000+101
 intlbfgs> interpolation using closest constraints
 checkrep> number of active repulsions and total=       0       0
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.4201981994         4.399852474    
 intlbfgs> largest atomic distance between images is     0.2004567221     for atom     14 and images      1     2 total images=     1
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.4139637082        0.2220446049E-13
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:      7   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.7444719549E-01         7     3
 intlbfgs> Choosing new active atom       13 new constraints=       7 maximum constraints available and possible=       7       7 shortest constraint=        1.01441
 intlbfgs> New active atom     13 closest average distances in endpoints:
     4    12    11     9     6    14    15
 intlbfgs> sorted average distances:
   1.014       1.624       1.633       3.051       3.358       3.864       4.191    
 intlbfgs> New active atom is number     13 total=     8 steps=     8
 intlbfgs> New active atom     13 is constrained to      7 other active atoms:
     4    12    11     9     6    14    15
 intlbfgs> sorted distances:
   1.014       1.624       1.633       3.051       3.358       3.864       4.191    
 intlbfgs> Turning on constraint     21 for atoms      4    13
 intlbfgs> Turning on constraint     42 for atoms     12    13
 intlbfgs> Turning on constraint     39 for atoms     11    13
 intlbfgs> Turning on constraint     35 for atoms      9    13
 intlbfgs> Turning on constraint     29 for atoms      6    13
 intlbfgs> Turning on constraint     45 for atoms     13    14
 intlbfgs> Turning on constraint     46 for atoms     13    15
 intlbfgs> initial guess from closest three constrained active atoms,      4    12    11
 checkrep> number of active repulsions and total=       0       0
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.4390110612        0.3831241470    
 intlbfgs> energies for constrained, preserved, closest, and linear schemes=     0.0000        0.10000+101    0.10000+101    0.10000+101
 intlbfgs> interpolation using closest constraints
 checkrep> number of active repulsions and total=       0       0
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.4390110612        0.3831241470    
 intlbfgs> largest atomic distance between images is     0.2004567221     for atom     14 and images      2     3 total images=     1
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.4386503628        0.1110223025E-13
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:      8   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.1787176601E-01         8     3
 intlbfgs> Choosing new active atom        2 new constraints=       3 maximum constraints available and possible=       4       3 shortest constraint=        2.17004
 intlbfgs> New active atom      2 closest average distances in endpoints:
     6     4    14    15    12    13    11     9
 intlbfgs> sorted average distances:
   2.151       2.170       2.677       2.679       2.707       2.720       2.734       2.746    
 intlbfgs> New active atom is number      2 total=     9 steps=     9
 intlbfgs> New active atom      2 is constrained to      3 other active atoms:
     4    12    13
 intlbfgs> sorted distances:
   2.170       2.707       2.720    
 intlbfgs> Turning on constraint      5 for atoms      2     4
 intlbfgs> Turning on constraint      8 for atoms      2    12
 intlbfgs> Turning on constraint      9 for atoms      2    13
 intlbfgs> initial guess from closest three constrained active atoms,      4    12    13
 checkrep> number of active repulsions and total=       5       5
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=     0.0000     d,ref,cutoff=     1.3508         1.7205        0.28316     max grad=     0.0000    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.4655895467         2.062228292    
 intlbfgs> energies for constrained, preserved, closest, and linear schemes=     0.0000        0.10000+101    0.10000+101    0.10000+101
 intlbfgs> interpolation using closest constraints
 checkrep> number of active repulsions and total=       5       5
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=     0.0000     d,ref,cutoff=     1.3508         1.7205        0.28316     max grad=     0.0000    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.4655895467         2.062228292    
 intlbfgs> largest atomic distance between images is     0.2004567221     for atom     14 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=     0.0000     d,ref,cutoff=     1.3956         1.7205        0.28316     max grad=     0.0000    
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.4584321713        0.1665334537E-13
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:      9     0.000000000       -0.1000000000+201     0.000000000         0.000000000        0.8188870194E-01         9     3
 intlbfgs> Mean deviation     0.1665334537E-13 Decreasing QCI force constant to      2.940888148    
 intlbfgs> Choosing new active atom        5 new constraints=       4 maximum constraints available and possible=       4       4 shortest constraint=        1.59364
 intlbfgs> New active atom      5 closest average distances in endpoints:
     2     6    15    14     9     4    12    11    13
 intlbfgs> sorted average distances:
   1.594       2.638       2.764       2.868       3.560       3.742       4.197       4.206       4.282    
 intlbfgs> New active atom is number      5 total=    10 steps=    10
 intlbfgs> New active atom      5 is constrained to      4 other active atoms:
     2     4    12    13
 intlbfgs> sorted distances:
   1.594       3.742       4.197       4.282    
 intlbfgs> Turning on constraint      6 for atoms      2     5
 intlbfgs> Turning on constraint     16 for atoms      4     5
 intlbfgs> Turning on constraint     24 for atoms      5    12
 intlbfgs> Turning on constraint     25 for atoms      5    13
 intlbfgs> initial guess from closest three constrained active atoms,      2     4    12
 checkrep> number of active repulsions and total=      10      10
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=     0.0000     d,ref,cutoff=     1.3956         1.7205        0.28316     max grad=     0.0000    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.5856928865         16.50263565    
 intlbfgs> energies for constrained, preserved, closest, and linear schemes=     0.0000        0.10000+101    0.10000+101    0.10000+101
 intlbfgs> interpolation using closest constraints
 checkrep> number of active repulsions and total=      10      10
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=     0.0000     d,ref,cutoff=     1.3956         1.7205        0.28316     max grad=     0.0000    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.5856928865         16.50263565    
 intlbfgs> largest atomic distance between images is     0.3238171738     for atom      5 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=     0.0000     d,ref,cutoff=     1.3956         1.7205        0.28316     max grad=     0.0000    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.5402665159         3.886560872    
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:     10     0.000000000       -0.1000000000+201     0.000000000         0.000000000        0.2476472407            10     3
 intlbfgs> Choosing new active atom       10 new constraints=       1 maximum constraints available and possible=       4       1 shortest constraint=        1.72050
 intlbfgs> New active atom     10 closest average distances in endpoints:
     5     2     6     4    14    12    13    15     9    11
 intlbfgs> sorted average distances:
   1.635       1.721       3.293       3.313       3.473       3.519       3.727       3.728       4.028       4.043    
 intlbfgs> New active atom is number     10 total=    11 steps=    11
 intlbfgs> New active atom     10 is constrained to      1 other active atoms:
     2
 intlbfgs> sorted distances:
   1.721    
 intlbfgs> Turning on constraint      7 for atoms      2    10
 intlbfgs> choosing positions      1     2     3 in closest list
 checkrep> number of active repulsions and total=      19      19
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.26200     d,ref,cutoff=     1.3487         1.7205        0.28316     max grad=     4.0184    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.048246171         3.660909161    
 intlbfgs> energies for constrained, preserved, closest, and linear schemes=    0.10000+101    0.10000+101    0.26200        0.10000+101
 intlbfgs> lowest energy from interpolation using closest atoms
 checkrep> number of active repulsions and total=      19      19
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.26200     d,ref,cutoff=     1.3487         1.7205        0.28316     max grad=     4.0184    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.048246171         3.660909161    
 intlbfgs> largest atomic distance between images is     0.9419438052     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind      3 atoms     11     2 value=    0.32398E-03 d,cutoff=     2.6189         2.6462     max grad=    0.22596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.059615879         4.703577848    
 intlbfgs> Highest image        2 energy     0.3239778802E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     11   -0.1000000000+201    0.3239778802E-03   -0.1000000000+201    0.2259590992E-01     1.646359658            11     3
 intlbfgs> Choosing new active atom        3 new constraints=       4 maximum constraints available and possible=       4       4 shortest constraint=        4.35571
 intlbfgs> New active atom      3 closest average distances in endpoints:
    10     2     5    12     4    13    11     6    15    14
 intlbfgs> sorted average distances:
   1.874       2.213       2.698       2.799       3.069       3.739       3.780       4.356       4.764       4.812    
 intlbfgs> New active atom is number      3 total=    12 steps=    12
 intlbfgs> New active atom      3 is constrained to      4 other active atoms:
     6    15    14     9
 intlbfgs> sorted distances:
   4.356       4.764       4.812       4.906    
 intlbfgs> Turning on constraint     10 for atoms      3     6
 intlbfgs> Turning on constraint     15 for atoms      3    15
 intlbfgs> Turning on constraint     14 for atoms      3    14
 intlbfgs> Turning on constraint     13 for atoms      3     9
 intlbfgs> initial guess from closest three constrained active atoms,      6    15    14
 checkrep> number of active repulsions and total=      26      26
 congrad> Highest repulsion  for image      2 ind      3 atoms     11     2 value=    0.32398E-03 d,cutoff=     2.6189         2.6462     max grad=    0.22596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.093184962         6.649497507    
 intlbfgs> energies for constrained, preserved, closest, and linear schemes=    0.32398E-03    0.10000+101    0.10000+101    0.10000+101
 intlbfgs> interpolation using closest constraints
 checkrep> number of active repulsions and total=      26      26
 congrad> Highest repulsion  for image      2 ind      3 atoms     11     2 value=    0.32398E-03 d,cutoff=     2.6189         2.6462     max grad=    0.22596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.093184962         6.649497507    
 intlbfgs> largest atomic distance between images is     0.9369623958     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind      3 atoms     11     2 value=    0.12371E-04 d,cutoff=     2.6409         2.6462     max grad=    0.43655E-02
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.085276358         5.370504392    
 intlbfgs> Highest image        2 energy     0.1237069572E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:     12   -0.1000000000+201    0.1237069572E-04   -0.1000000000+201    0.4365510570E-02    0.5587587273E-01        12     3
 intlbfgs> Choosing new active atom        1 new constraints=       2 maximum constraints available and possible=       2       2 shortest constraint=        1.08673
 intlbfgs> New active atom      1 closest average distances in endpoints:
     3    10    12     2     4    13     5    11     6     9
 intlbfgs> sorted average distances:
   1.087       2.470       2.561       2.840       3.077       3.591       3.615       3.884       4.929       5.346    
 intlbfgs> New active atom is number      1 total=    13 steps=    13
 intlbfgs> New active atom      1 is constrained to      2 other active atoms:
     3    15
 intlbfgs> sorted distances:
   1.087       5.466    
 intlbfgs> Turning on constraint      1 for atoms      1     3
 intlbfgs> Turning on constraint      4 for atoms      1    15
 intlbfgs> choosing positions      1     2     3 in closest list
 checkrep> number of active repulsions and total=      36      36
 congrad> Highest constraint for image      2 con      3 atoms      1     8 value=     0.0000     d,ref,cutoff=     1.5578         1.7808        0.21700     max grad=    -0.0000    
 congrad> Highest repulsion  for image      2 ind      3 atoms     11     2 value=    0.12371E-04 d,cutoff=     2.6409         2.6462     max grad=    0.43655E-02
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.155712487         7.410092270    
 intlbfgs> energies for constrained, preserved, closest, and linear schemes=    0.10000+101    0.10000+101    0.12371E-04    0.10000+101
 intlbfgs> lowest energy from interpolation using closest atoms
 checkrep> number of active repulsions and total=      36      36
 congrad> Highest constraint for image      2 con      3 atoms      1     8 value=     0.0000     d,ref,cutoff=     1.5578         1.7808        0.21700     max grad=    -0.0000    
 congrad> Highest repulsion  for image      2 ind      3 atoms     11     2 value=    0.12371E-04 d,cutoff=     2.6409         2.6462     max grad=    0.43655E-02
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.155712487         7.410092270    
 intlbfgs> largest atomic distance between images is     0.9120413920     for atom     10 and images      2     3 total images=     1
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.120766864         2.671087532    
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:     13   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.3026253148            13     3
 intlbfgs> Choosing new active atom        8 new constraints=       2 maximum constraints available and possible=       2       2 shortest constraint=        1.08336
 intlbfgs> New active atom      8 closest average distances in endpoints:
     3     1    10     5     2    12     4    13    11     6
 intlbfgs> sorted average distances:
   1.083       1.781       2.127       2.768       2.879       3.874       4.108       4.735       4.812       4.933    
 intlbfgs> New active atom is number      8 total=    14 steps=    14
 intlbfgs> New active atom      8 is constrained to      2 other active atoms:
     3     1
 intlbfgs> sorted distances:
   1.083       1.781    
 intlbfgs> Turning on constraint     12 for atoms      3     8
 intlbfgs> Turning on constraint      3 for atoms      1     8
 intlbfgs> choosing positions      1     2     3 in closest list
 checkrep> number of active repulsions and total=      47      47
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.136202925         2.457050681    
 intlbfgs> energies for constrained, preserved, closest, and linear schemes=    0.10000+101    0.10000+101     0.0000        0.10000+101
 intlbfgs> lowest energy from interpolation using closest atoms
 checkrep> number of active repulsions and total=      47      47
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.136202925         2.457050681    
 intlbfgs> largest atomic distance between images is     0.8978139533     for atom     10 and images      2     3 total images=     1
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=     1.126188329        0.1525094095    
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:     14   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.1447418702            14     3
 intlbfgs> Mean deviation     0.1525094095     Decreasing QCI force constant to      2.911770444    
 intlbfgs> Choosing new active atom        7 new constraints=       3 maximum constraints available and possible=       3       3 shortest constraint=        1.08965
 intlbfgs> New active atom      7 closest average distances in endpoints:
     3     8     1     2    10    12     5     4    11    13
 intlbfgs> sorted average distances:
   1.090       1.761       1.783       2.478       2.698       2.772       2.970       3.100       3.571       3.953    
 intlbfgs> New active atom is number      7 total=    15 steps=    15
 intlbfgs> New active atom      7 is constrained to      3 other active atoms:
     3     8     1
 intlbfgs> sorted distances:
   1.090       1.761       1.783    
 intlbfgs> Turning on constraint     11 for atoms      3     7
 intlbfgs> Turning on constraint     32 for atoms      7     8
 intlbfgs> Turning on constraint      2 for atoms      1     7
 intlbfgs> initial guess from closest three constrained active atoms,      3     8     1
 checkrep> number of active repulsions and total=      58      58
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=     1.222597229        0.1963773771E-01
 intlbfgs> energies for constrained, preserved, closest, and linear schemes=     0.0000        0.10000+101    0.10000+101    0.10000+101
 intlbfgs> interpolation using closest constraints
 checkrep> number of active repulsions and total=      58      58
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=     1.222597229        0.1963773771E-01
 intlbfgs> largest atomic distance between images is     0.8961831821     for atom     10 and images      2     3 total images=     1
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=     1.219921132        0.2061472309    
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:     15   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.6987683787E-01        15     3
 intlbfgs> switch on true potential at step     15 fraction=    0.000000 images=     1 time=    0.2827000000E-02
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> Allowing   1000 further optimization steps
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.8962093799     for atom     10 and images      2     3 total images=     1
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.220723589        0.1303503006    
 intlbfgs> Highest QCI image energy=     0.000000000     images=       1
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:     16   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.5746910164E-01        15     3
 intlbfgs> largest atomic distance between images is     0.8973686422     for atom     10 and images      2     3 total images=     1
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.220600983        0.3411516766    
 intlbfgs> Highest QCI image energy=     0.000000000     images=       1
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:     17   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.1123752473E-01        15     3
 intlbfgs> largest atomic distance between images is     0.8995337576     for atom     10 and images      1     2 total images=     1
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.232616801        0.1376473315    
 intlbfgs> Highest QCI image energy=     0.000000000     images=       1
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:     18   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000         1.434718522            15     3
 intlbfgs> largest atomic distance between images is     0.8960099724     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.71060E-01 d,ref,cutoff=     1.3882         1.7205        0.28316     max grad=     1.9634    
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=     1.218839212        0.2074492554E-01
 intlbfgs> Highest QCI image energy=    0.7105986575E-01 images=       1
 intlbfgs> Highest image        2 energy     0.7105986575E-01 is      0.000000000     sigma from the mean
 intlbfgs> steps:     19    0.7105986575E-01   -0.1000000000+201     1.963416489         0.000000000        0.1860091830            15     3
 intlbfgs> Mean deviation     0.2074492554E-01 Decreasing QCI force constant to      2.882941033    
 intlbfgs> largest atomic distance between images is     0.9062509707     for atom     10 and images      2     3 total images=     1
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.223152402         2.242735611    
 intlbfgs> Highest QCI image energy=     0.000000000     images=       1
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:     20   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.1098545966            15     3
 intlbfgs> largest atomic distance between images is     0.8993699876     for atom     10 and images      2     3 total images=     1
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.221194426         1.034620247    
 intlbfgs> Highest QCI image energy=     0.000000000     images=       1
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:     21   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.6428430586E-01        15     3
 intlbfgs> largest atomic distance between images is     0.8954236963     for atom     10 and images      1     2 total images=     1
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=     1.221031867        0.5447247001    
 intlbfgs> Highest QCI image energy=     0.000000000     images=       1
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:     22   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.9195082335E-01        15     3
 intlbfgs> largest atomic distance between images is     0.8959866475     for atom     10 and images      2     3 total images=     1
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=     1.219802266        0.3719021202E-01
 intlbfgs> Highest QCI image energy=     0.000000000     images=       1
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:     23   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.5171695714E-01        15     3
 intlbfgs> largest atomic distance between images is     0.8959850533     for atom     10 and images      2     3 total images=     1
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219426271        0.9106815433E-01
 intlbfgs> Highest QCI image energy=     0.000000000     images=       1
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:     24   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.1343674980E-01        15     3
 intlbfgs> Mean deviation     0.9106815433E-01 Decreasing QCI force constant to      2.854397063    
 intlbfgs> largest atomic distance between images is     0.8941909213     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.49997E-01 d,ref,cutoff=     1.3956         1.7205        0.28316     max grad=     1.6104    
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=     1.218798747        0.3885780586E-13
 intlbfgs> Highest QCI image energy=    0.4999653284E-01 images=       1
 intlbfgs> Highest image        2 energy     0.4999653284E-01 is      0.000000000     sigma from the mean
 intlbfgs> steps:     25    0.4999653284E-01   -0.1000000000+201     1.610374878         0.000000000        0.3913154734E-01        15     3
 intlbfgs> largest atomic distance between images is     0.8958155722     for atom     10 and images      2     3 total images=     1
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219349851        0.7493346238E-01
 intlbfgs> Highest QCI image energy=     0.000000000     images=       1
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:     26   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.3666752438E-01        15     3
 intlbfgs> largest atomic distance between images is     0.8957129042     for atom     10 and images      2     3 total images=     1
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219289120        0.7308510736E-01
 intlbfgs> Highest QCI image energy=     0.000000000     images=       1
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:     27   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.2116322686E-02        15     3
 intlbfgs> largest atomic distance between images is     0.8942128763     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.49395E-01 d,ref,cutoff=     1.3959         1.7205        0.28316     max grad=     1.5994    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.218798852        0.5354245872E-02
 intlbfgs> Highest QCI image energy=    0.4939532925E-01 images=       1
 intlbfgs> Highest image        2 energy     0.4939532925E-01 is      0.000000000     sigma from the mean
 intlbfgs> steps:     28    0.4939532925E-01   -0.1000000000+201     1.599378895         0.000000000        0.3449563465E-01        15     3
 intlbfgs> largest atomic distance between images is     0.8956353218     for atom     10 and images      2     3 total images=     1
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219237476        0.7476506959E-01
 intlbfgs> Highest QCI image energy=     0.000000000     images=       1
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:     29   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.3261942747E-01        15     3
 intlbfgs> Mean deviation     0.7476506959E-01 Decreasing QCI force constant to      2.826135706    
 intlbfgs> largest atomic distance between images is     0.8955655969     for atom     10 and images      2     3 total images=     1
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219193822        0.7576868016E-01
 intlbfgs> Highest QCI image energy=     0.000000000     images=       1
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:     30   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.1704155217E-02        15     3
 intlbfgs> largest atomic distance between images is     0.8944495500     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.32548E-01 d,ref,cutoff=     1.4033         1.7205        0.28316     max grad=     1.2687    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.218810703        0.2960458889E-01
 intlbfgs> Highest QCI image energy=    0.3254844917E-01 images=       1
 intlbfgs> Highest image        2 energy     0.3254844917E-01 is      0.000000000     sigma from the mean
 intlbfgs> steps:     31    0.3254844917E-01   -0.1000000000+201     1.268749272         0.000000000        0.2577940831E-01        15     3
 intlbfgs> largest atomic distance between images is     0.8955048526     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.24221E-05 d,ref,cutoff=     1.4370         1.7205        0.28316     max grad=    0.97856E-02
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219155095        0.7751959865E-01
 intlbfgs> Highest QCI image energy=    0.2422097873E-05 images=       1
 intlbfgs> Highest image        2 energy     0.2422097873E-05 is      0.000000000     sigma from the mean
 intlbfgs> steps:     32    0.2422097873E-05   -0.1000000000+201    0.9785560554E-02     0.000000000        0.2420701151E-01        15     3
 intlbfgs> largest atomic distance between images is     0.8954584335     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.98198E-04 d,ref,cutoff=     1.4354         1.7205        0.28316     max grad=    0.62670E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219126187        0.7897444789E-01
 intlbfgs> Highest QCI image energy=    0.9819768401E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9819768401E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:     33    0.9819768401E-04   -0.1000000000+201    0.6266989919E-01     0.000000000        0.1252204366E-02        15     3
 intlbfgs> largest atomic distance between images is     0.8954639971     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.13197E-03 d,ref,cutoff=     1.4350         1.7205        0.28316     max grad=    0.72728E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219120247        0.8338646570E-01
 intlbfgs> Highest QCI image energy=    0.1319676314E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1319676314E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     34    0.1319676314E-03   -0.1000000000+201    0.7272768278E-01     0.000000000        0.3930720797E-03        15     3
 intlbfgs> Mean deviation     0.8338646570E-01 Decreasing QCI force constant to      2.798154164    
 intlbfgs> largest atomic distance between images is     0.8954877494     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.15300E-03 d,ref,cutoff=     1.4349         1.7205        0.28316     max grad=    0.78352E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219116215        0.9183138057E-01
 intlbfgs> Highest QCI image energy=    0.1530010974E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1530010974E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     35    0.1530010974E-03   -0.1000000000+201    0.7835164926E-01     0.000000000        0.5363555575E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8955552382     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16144E-03 d,ref,cutoff=     1.4348         1.7205        0.28316     max grad=    0.80490E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219113205        0.1119547964    
 intlbfgs> Highest QCI image energy=    0.1614427955E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1614427955E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     36    0.1614427955E-03   -0.1000000000+201    0.8049009745E-01     0.000000000        0.1158760301E-02        15     3
 intlbfgs> largest atomic distance between images is     0.8956431731     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.12915E-03 d,ref,cutoff=     1.4351         1.7205        0.28316     max grad=    0.71912E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219116567        0.1345086740    
 intlbfgs> Highest QCI image energy=    0.1291469250E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1291469250E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     37    0.1291469250E-03   -0.1000000000+201    0.7191189495E-01     0.000000000        0.1173846455E-02        15     3
 intlbfgs> largest atomic distance between images is     0.8956510979     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.12145E-03 d,ref,cutoff=     1.4351         1.7205        0.28316     max grad=    0.69719E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219117645        0.1360738051    
 intlbfgs> Highest QCI image energy=    0.1214517951E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1214517951E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     38    0.1214517951E-03   -0.1000000000+201    0.6971930403E-01     0.000000000        0.7882863724E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956507541     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.12059E-03 d,ref,cutoff=     1.4351         1.7205        0.28316     max grad=    0.69469E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219117775        0.1358815303    
 intlbfgs> Highest QCI image energy=    0.1205869694E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1205869694E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     39    0.1205869694E-03   -0.1000000000+201    0.6946886978E-01     0.000000000        0.1616176305E-04        15     3
 intlbfgs> Mean deviation     0.1358815303     Decreasing QCI force constant to      2.770449667    
 intlbfgs> largest atomic distance between images is     0.8956508257     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.12052E-03 d,ref,cutoff=     1.4351         1.7205        0.28316     max grad=    0.69450E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219117785        0.1358743645    
 intlbfgs> Highest QCI image energy=    0.1205207771E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1205207771E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     40    0.1205207771E-03   -0.1000000000+201    0.6944967371E-01     0.000000000        0.3563287501E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956514519     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.12048E-03 d,ref,cutoff=     1.4351         1.7205        0.28316     max grad=    0.69438E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219117796        0.1356511862    
 intlbfgs> Highest QCI image energy=    0.1204783904E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1204783904E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     41    0.1204783904E-03   -0.1000000000+201    0.6943772355E-01     0.000000000        0.6483251483E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956537889     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.12056E-03 d,ref,cutoff=     1.4351         1.7205        0.28316     max grad=    0.69462E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219117769        0.1364385308    
 intlbfgs> Highest QCI image energy=    0.1205649069E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1205649069E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     42    0.1205649069E-03   -0.1000000000+201    0.6946236018E-01     0.000000000        0.5516141215E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956519192     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.12052E-03 d,ref,cutoff=     1.4351         1.7205        0.28316     max grad=    0.69449E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219117782        0.1360461215    
 intlbfgs> Highest QCI image energy=    0.1205177219E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1205177219E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     43    0.1205177219E-03   -0.1000000000+201    0.6944878413E-01     0.000000000        0.1681306294E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956525459     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.12023E-03 d,ref,cutoff=     1.4352         1.7205        0.28316     max grad=    0.69364E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219117823        0.1361446619    
 intlbfgs> Highest QCI image energy=    0.1202272062E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1202272062E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     44    0.1202272062E-03   -0.1000000000+201    0.6936438904E-01     0.000000000        0.7272625130E-05        15     3
 intlbfgs> Mean deviation     0.1361446619     Decreasing QCI force constant to      2.743019473    
 intlbfgs> largest atomic distance between images is     0.8956532604     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.11819E-03 d,ref,cutoff=     1.4352         1.7205        0.28316     max grad=    0.68769E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219118122        0.1362587440    
 intlbfgs> Highest QCI image energy=    0.1181863661E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1181863661E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     45    0.1181863661E-03   -0.1000000000+201    0.6876862869E-01     0.000000000        0.1592449033E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.8956530349     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.89561E-04 d,ref,cutoff=     1.4354         1.7205        0.28316     max grad=    0.59805E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219122699        0.1354546733    
 intlbfgs> Highest QCI image energy=    0.8956090030E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8956090030E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:     46    0.8956090030E-04   -0.1000000000+201    0.5980549567E-01     0.000000000        0.2506598321E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956541166     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.11622E-03 d,ref,cutoff=     1.4352         1.7205        0.28316     max grad=    0.68190E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219118413        0.1363530873    
 intlbfgs> Highest QCI image energy=    0.1162195400E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1162195400E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     47    0.1162195400E-03   -0.1000000000+201    0.6818970120E-01     0.000000000        0.2413041625E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956542649     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.11620E-03 d,ref,cutoff=     1.4352         1.7205        0.28316     max grad=    0.68185E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219118416        0.1363664532    
 intlbfgs> Highest QCI image energy=    0.1162035806E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1162035806E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     48    0.1162035806E-03   -0.1000000000+201    0.6818499336E-01     0.000000000        0.3389663993E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956546213     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.11619E-03 d,ref,cutoff=     1.4352         1.7205        0.28316     max grad=    0.68180E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219118417        0.1364006167    
 intlbfgs> Highest QCI image energy=    0.1161877783E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1161877783E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     49    0.1161877783E-03   -0.1000000000+201    0.6818028814E-01     0.000000000        0.2538121190E-05        15     3
 intlbfgs> Mean deviation     0.1364006167     Decreasing QCI force constant to      2.715860864    
 intlbfgs> largest atomic distance between images is     0.8956546756     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.11619E-03 d,ref,cutoff=     1.4352         1.7205        0.28316     max grad=    0.68180E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219118417        0.1364042893    
 intlbfgs> Highest QCI image energy=    0.1161871703E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1161871703E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     50    0.1161871703E-03   -0.1000000000+201    0.6818009883E-01     0.000000000        0.1449966820E-06        15     3
 intlbfgs> largest atomic distance between images is     0.8956601173     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.11619E-03 d,ref,cutoff=     1.4352         1.7205        0.28316     max grad=    0.68179E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219118411        0.1367731197    
 intlbfgs> Highest QCI image energy=    0.1161866226E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1161866226E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     51    0.1161866226E-03   -0.1000000000+201    0.6817897497E-01     0.000000000        0.1458591856E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956547297     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.11618E-03 d,ref,cutoff=     1.4352         1.7205        0.28316     max grad=    0.68179E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219118418        0.1364031567    
 intlbfgs> Highest QCI image energy=    0.1161833864E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1161833864E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     52    0.1161833864E-03   -0.1000000000+201    0.6817898490E-01     0.000000000        0.1455908196E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956545933     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.11618E-03 d,ref,cutoff=     1.4352         1.7205        0.28316     max grad=    0.68178E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219118418        0.1363984917    
 intlbfgs> Highest QCI image energy=    0.1161809963E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1161809963E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     53    0.1161809963E-03   -0.1000000000+201    0.6817829801E-01     0.000000000        0.8766651073E-06        15     3
 intlbfgs> largest atomic distance between images is     0.8956538744     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.11615E-03 d,ref,cutoff=     1.4352         1.7205        0.28316     max grad=    0.68170E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219118423        0.1363677827    
 intlbfgs> Highest QCI image energy=    0.1161511071E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1161511071E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     54    0.1161511071E-03   -0.1000000000+201    0.6816955034E-01     0.000000000        0.5733721049E-05        15     3
 intlbfgs> Mean deviation     0.1363677827     Decreasing QCI force constant to      2.688971153    
 intlbfgs> largest atomic distance between images is     0.8956851144     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.88869E-04 d,ref,cutoff=     1.4355         1.7205        0.28316     max grad=    0.59570E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219122769        0.1381184455    
 intlbfgs> Highest QCI image energy=    0.8886927767E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8886927767E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:     55    0.8886927767E-04   -0.1000000000+201    0.5957008323E-01     0.000000000        0.2269498530E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956556467     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.11386E-03 d,ref,cutoff=     1.4352         1.7205        0.28316     max grad=    0.67488E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219118766        0.1364742004    
 intlbfgs> Highest QCI image energy=    0.1138571678E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1138571678E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     56    0.1138571678E-03   -0.1000000000+201    0.6748787849E-01     0.000000000        0.2116487277E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956566759     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.11191E-03 d,ref,cutoff=     1.4352         1.7205        0.28316     max grad=    0.66904E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219119061        0.1365466797    
 intlbfgs> Highest QCI image energy=    0.1119085612E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1119085612E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     57    0.1119085612E-03   -0.1000000000+201    0.6690355041E-01     0.000000000        0.1291533929E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956566517     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.11191E-03 d,ref,cutoff=     1.4352         1.7205        0.28316     max grad=    0.66904E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219119061        0.1365460399    
 intlbfgs> Highest QCI image energy=    0.1119102532E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1119102532E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     58    0.1119102532E-03   -0.1000000000+201    0.6690406406E-01     0.000000000        0.9920215941E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8956564822     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.11191E-03 d,ref,cutoff=     1.4352         1.7205        0.28316     max grad=    0.66905E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219119061        0.1365426086    
 intlbfgs> Highest QCI image energy=    0.1119119389E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1119119389E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     59    0.1119119389E-03   -0.1000000000+201    0.6690460388E-01     0.000000000        0.6479981744E-06        15     3
 intlbfgs> Mean deviation     0.1365426086     Decreasing QCI force constant to      2.662347676    
 intlbfgs> largest atomic distance between images is     0.8956563970     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.11191E-03 d,ref,cutoff=     1.4352         1.7205        0.28316     max grad=    0.66904E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219119061        0.1365432663    
 intlbfgs> Highest QCI image energy=    0.1119112981E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1119112981E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     60    0.1119112981E-03   -0.1000000000+201    0.6690443461E-01     0.000000000        0.7013528215E-06        15     3
 intlbfgs> largest atomic distance between images is     0.8953836370     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.11099E-03 d,ref,cutoff=     1.4352         1.7205        0.28316     max grad=    0.66701E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219121216        0.1385961305    
 intlbfgs> Highest QCI image energy=    0.1109880742E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1109880742E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     61    0.1109880742E-03   -0.1000000000+201    0.6670132810E-01     0.000000000        0.2241539193E-02        15     3
 intlbfgs> largest atomic distance between images is     0.8956563218     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.11191E-03 d,ref,cutoff=     1.4352         1.7205        0.28316     max grad=    0.66904E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219119061        0.1365439569    
 intlbfgs> Highest QCI image energy=    0.1119114005E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1119114005E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     62    0.1119114005E-03   -0.1000000000+201    0.6690448724E-01     0.000000000        0.2240838482E-02        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.8956563246     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.11191E-03 d,ref,cutoff=     1.4352         1.7205        0.28316     max grad=    0.66904E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219119061        0.1365440429    
 intlbfgs> Highest QCI image energy=    0.1119110345E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1119110345E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     63    0.1119110345E-03   -0.1000000000+201    0.6690437657E-01     0.000000000        0.1071704511E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8956642423     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.11077E-03 d,ref,cutoff=     1.4352         1.7205        0.28316     max grad=    0.66558E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219119232        0.1367950375    
 intlbfgs> Highest QCI image energy=    0.1107675236E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1107675236E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     64    0.1107675236E-03   -0.1000000000+201    0.6655789729E-01     0.000000000        0.3077461495E-04        15     3
 intlbfgs> Mean deviation     0.1367950375     Decreasing QCI force constant to      2.635987798    
 intlbfgs> largest atomic distance between images is     0.8956582986     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.10997E-03 d,ref,cutoff=     1.4352         1.7205        0.28316     max grad=    0.66316E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219119357        0.1366429270    
 intlbfgs> Highest QCI image energy=    0.1099670308E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1099670308E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     65    0.1099670308E-03   -0.1000000000+201    0.6631626783E-01     0.000000000        0.2561974216E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8954488611     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.93219E-04 d,ref,cutoff=     1.4354         1.7205        0.28316     max grad=    0.61056E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219122440        0.1310451113    
 intlbfgs> Highest QCI image energy=    0.9321891278E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9321891278E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:     66    0.9321891278E-04   -0.1000000000+201    0.6105626738E-01     0.000000000        0.8735572023E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956490632     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.10954E-03 d,ref,cutoff=     1.4353         1.7205        0.28316     max grad=    0.66189E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219119427        0.1363880932    
 intlbfgs> Highest QCI image energy=    0.1095418471E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1095418471E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     67    0.1095418471E-03   -0.1000000000+201    0.6618859944E-01     0.000000000        0.8358558849E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.8956506068     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.10927E-03 d,ref,cutoff=     1.4353         1.7205        0.28316     max grad=    0.66107E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219119467        0.1364385976    
 intlbfgs> Highest QCI image energy=    0.1092743055E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1092743055E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     68    0.1092743055E-03   -0.1000000000+201    0.6610689044E-01     0.000000000        0.6053867584E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956579358     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.10779E-03 d,ref,cutoff=     1.4353         1.7205        0.28316     max grad=    0.65651E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219119694        0.1366829413    
 intlbfgs> Highest QCI image energy=    0.1077861309E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1077861309E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     69    0.1077861309E-03   -0.1000000000+201    0.6565080819E-01     0.000000000        0.2887199401E-04        15     3
 intlbfgs> Mean deviation     0.1366829413     Decreasing QCI force constant to      2.609888909    
 intlbfgs> largest atomic distance between images is     0.8956579392     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.10779E-03 d,ref,cutoff=     1.4353         1.7205        0.28316     max grad=    0.65651E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219119694        0.1366824619    
 intlbfgs> Highest QCI image energy=    0.1077855320E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1077855320E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     70    0.1077855320E-03   -0.1000000000+201    0.6565062281E-01     0.000000000        0.8886241061E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8956590302     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.10778E-03 d,ref,cutoff=     1.4353         1.7205        0.28316     max grad=    0.65650E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219119697        0.1365070123    
 intlbfgs> Highest QCI image energy=    0.1077845127E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1077845127E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     71    0.1077845127E-03   -0.1000000000+201    0.6564972541E-01     0.000000000        0.3117565292E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956585095     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.10779E-03 d,ref,cutoff=     1.4353         1.7205        0.28316     max grad=    0.65651E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219119694        0.1366876883    
 intlbfgs> Highest QCI image energy=    0.1077859660E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1077859660E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     72    0.1077859660E-03   -0.1000000000+201    0.6565063820E-01     0.000000000        0.2995534050E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956565683     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.10779E-03 d,ref,cutoff=     1.4353         1.7205        0.28316     max grad=    0.65651E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219119694        0.1366452690    
 intlbfgs> Highest QCI image energy=    0.1077868941E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1077868941E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     73    0.1077868941E-03   -0.1000000000+201    0.6565127436E-01     0.000000000        0.7370699134E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956581232     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.10779E-03 d,ref,cutoff=     1.4353         1.7205        0.28316     max grad=    0.65651E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219119694        0.1366786131    
 intlbfgs> Highest QCI image energy=    0.1077863028E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1077863028E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     74    0.1077863028E-03   -0.1000000000+201    0.6565081009E-01     0.000000000        0.5892922909E-05        15     3
 intlbfgs> Mean deviation     0.1366786131     Decreasing QCI force constant to      2.584048424    
 intlbfgs> largest atomic distance between images is     0.8956741404     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.69891E-04 d,ref,cutoff=     1.4357         1.7205        0.28316     max grad=    0.52791E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219126241        0.1380522706    
 intlbfgs> Highest QCI image energy=    0.6989100514E-04 images=       1
 intlbfgs> Highest image        2 energy     0.6989100514E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:     75    0.6989100514E-04   -0.1000000000+201    0.5279072511E-01     0.000000000        0.2844250307E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956589210     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.10567E-03 d,ref,cutoff=     1.4353         1.7205        0.28316     max grad=    0.65000E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219120023        0.1367477769    
 intlbfgs> Highest QCI image energy=    0.1056737524E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1056737524E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     76    0.1056737524E-03   -0.1000000000+201    0.6499964838E-01     0.000000000        0.2700514329E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956596915     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.10381E-03 d,ref,cutoff=     1.4353         1.7205        0.28316     max grad=    0.64418E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219120317        0.1368107777    
 intlbfgs> Highest QCI image energy=    0.1038050578E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1038050578E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     77    0.1038050578E-03   -0.1000000000+201    0.6441827207E-01     0.000000000        0.1283368312E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956596905     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.10381E-03 d,ref,cutoff=     1.4353         1.7205        0.28316     max grad=    0.64419E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219120317        0.1368106419    
 intlbfgs> Highest QCI image energy=    0.1038084187E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1038084187E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     78    0.1038084187E-03   -0.1000000000+201    0.6441932222E-01     0.000000000        0.2355555990E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8956596905     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.10381E-03 d,ref,cutoff=     1.4353         1.7205        0.28316     max grad=    0.64419E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219120317        0.1368106102    
 intlbfgs> Highest QCI image energy=    0.1038085013E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1038085013E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     79    0.1038085013E-03   -0.1000000000+201    0.6441934796E-01     0.000000000        0.3875160836E-08        15     3
 intlbfgs> Mean deviation     0.1368106102     Decreasing QCI force constant to      2.558463787    
 intlbfgs> largest atomic distance between images is     0.8956596906     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.10381E-03 d,ref,cutoff=     1.4353         1.7205        0.28316     max grad=    0.64419E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219120317        0.1368101145    
 intlbfgs> Highest QCI image energy=    0.1038087510E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1038087510E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     80    0.1038087510E-03   -0.1000000000+201    0.6441942512E-01     0.000000000        0.6446599525E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8956597043     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.10381E-03 d,ref,cutoff=     1.4353         1.7205        0.28316     max grad=    0.64419E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219120317        0.1367842277    
 intlbfgs> Highest QCI image energy=    0.1038083864E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1038083864E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     81    0.1038083864E-03   -0.1000000000+201    0.6441926546E-01     0.000000000        0.3421610693E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956596889     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.10381E-03 d,ref,cutoff=     1.4353         1.7205        0.28316     max grad=    0.64419E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219120317        0.1368085663    
 intlbfgs> Highest QCI image energy=    0.1038077735E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1038077735E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     82    0.1038077735E-03   -0.1000000000+201    0.6441911746E-01     0.000000000        0.3208283484E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956596393     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.10380E-03 d,ref,cutoff=     1.4353         1.7205        0.28316     max grad=    0.64416E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219120318        0.1368122102    
 intlbfgs> Highest QCI image energy=    0.1037991206E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1037991206E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     83    0.1037991206E-03   -0.1000000000+201    0.6441643044E-01     0.000000000        0.6109489173E-06        15     3
 intlbfgs> largest atomic distance between images is     0.8956569070     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.10323E-03 d,ref,cutoff=     1.4353         1.7205        0.28316     max grad=    0.64240E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219120407        0.1368966348    
 intlbfgs> Highest QCI image energy=    0.1032344279E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1032344279E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     84    0.1032344279E-03   -0.1000000000+201    0.6424046975E-01     0.000000000        0.2021159728E-04        15     3
 intlbfgs> Mean deviation     0.1368966348     Decreasing QCI force constant to      2.533132462    
 intlbfgs> largest atomic distance between images is     0.8956609836     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.10109E-03 d,ref,cutoff=     1.4353         1.7205        0.28316     max grad=    0.63565E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219120753        0.1366947766    
 intlbfgs> Highest QCI image energy=    0.1010922194E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1010922194E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     85    0.1010922194E-03   -0.1000000000+201    0.6356463684E-01     0.000000000        0.4785433605E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956612968     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.96890E-04 d,ref,cutoff=     1.4354         1.7205        0.28316     max grad=    0.62220E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219121436        0.1367482847    
 intlbfgs> Highest QCI image energy=    0.9688981957E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9688981957E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:     86    0.9688981957E-04   -0.1000000000+201    0.6222042645E-01     0.000000000        0.3108093993E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956591197     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.10000E-03 d,ref,cutoff=     1.4353         1.7205        0.28316     max grad=    0.63219E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219120927        0.1368208996    
 intlbfgs> Highest QCI image energy=    0.1000003228E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1000003228E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     87    0.1000003228E-03   -0.1000000000+201    0.6321865961E-01     0.000000000        0.3360257059E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956589131     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.10000E-03 d,ref,cutoff=     1.4353         1.7205        0.28316     max grad=    0.63220E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219120926        0.1368498196    
 intlbfgs> Highest QCI image energy=    0.1000046404E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1000046404E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     88    0.1000046404E-03   -0.1000000000+201    0.6322012429E-01     0.000000000        0.4401770316E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956612730     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.99968E-04 d,ref,cutoff=     1.4353         1.7205        0.28316     max grad=    0.63208E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219120930        0.1369374673    
 intlbfgs> Highest QCI image energy=    0.9996794898E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9996794898E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:     89    0.9996794898E-04   -0.1000000000+201    0.6320809145E-01     0.000000000        0.1050209488E-04        15     3
 intlbfgs> Mean deviation     0.1369374673     Decreasing QCI force constant to      2.508051943    
 intlbfgs> largest atomic distance between images is     0.8956612910     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.99974E-04 d,ref,cutoff=     1.4353         1.7205        0.28316     max grad=    0.63210E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219120929        0.1369395539    
 intlbfgs> Highest QCI image energy=    0.9997422690E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9997422690E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:     90    0.9997422690E-04   -0.1000000000+201    0.6321008659E-01     0.000000000        0.9651838018E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8956612775     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.99968E-04 d,ref,cutoff=     1.4353         1.7205        0.28316     max grad=    0.63208E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219120930        0.1369378949    
 intlbfgs> Highest QCI image energy=    0.9996797421E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9996797421E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:     91    0.9996797421E-04   -0.1000000000+201    0.6320809865E-01     0.000000000        0.8088883101E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8956585114     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.98254E-04 d,ref,cutoff=     1.4354         1.7205        0.28316     max grad=    0.62661E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219121215        0.1366022587    
 intlbfgs> Highest QCI image energy=    0.9825425616E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9825425616E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:     92    0.9825425616E-04   -0.1000000000+201    0.6266076861E-01     0.000000000        0.1871441020E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956592636     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.98198E-04 d,ref,cutoff=     1.4354         1.7205        0.28316     max grad=    0.62643E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219121222        0.1366823509    
 intlbfgs> Highest QCI image energy=    0.9819804705E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9819804705E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:     93    0.9819804705E-04   -0.1000000000+201    0.6264260167E-01     0.000000000        0.2874329476E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956621863     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.98106E-04 d,ref,cutoff=     1.4354         1.7205        0.28316     max grad=    0.62612E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219121232        0.1369992980    
 intlbfgs> Highest QCI image energy=    0.9810553588E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9810553588E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:     94    0.9810553588E-04   -0.1000000000+201    0.6261242217E-01     0.000000000        0.1143549301E-04        15     3
 intlbfgs> Mean deviation     0.1369992980     Decreasing QCI force constant to      2.483219745    
 intlbfgs> largest atomic distance between images is     0.8956621587     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.98110E-04 d,ref,cutoff=     1.4354         1.7205        0.28316     max grad=    0.62614E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219121231        0.1370030897    
 intlbfgs> Highest QCI image energy=    0.9811007318E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9811007318E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:     95    0.9811007318E-04   -0.1000000000+201    0.6261388836E-01     0.000000000        0.3572561161E-06        15     3
 intlbfgs> largest atomic distance between images is     0.8956619397     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.98105E-04 d,ref,cutoff=     1.4354         1.7205        0.28316     max grad=    0.62612E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219121232        0.1370465798    
 intlbfgs> Highest QCI image energy=    0.9810496804E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9810496804E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:     96    0.9810496804E-04   -0.1000000000+201    0.6261232549E-01     0.000000000        0.3595764536E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956685554     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.97900E-04 d,ref,cutoff=     1.4354         1.7205        0.28316     max grad=    0.62545E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219121256        0.1376105196    
 intlbfgs> Highest QCI image energy=    0.9789986922E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9789986922E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:     97    0.9789986922E-04   -0.1000000000+201    0.6254525306E-01     0.000000000        0.2269190564E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956665245     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.97801E-04 d,ref,cutoff=     1.4354         1.7205        0.28316     max grad=    0.62514E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219121275        0.1374259305    
 intlbfgs> Highest QCI image energy=    0.9780128509E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9780128509E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:     98    0.9780128509E-04   -0.1000000000+201    0.6251389177E-01     0.000000000        0.7410312598E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956601301     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.96877E-04 d,ref,cutoff=     1.4354         1.7205        0.28316     max grad=    0.62217E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219121437        0.1368320521    
 intlbfgs> Highest QCI image energy=    0.9687746304E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9687746304E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:     99    0.9687746304E-04   -0.1000000000+201    0.6221706304E-01     0.000000000        0.2529204294E-04        15     3
 intlbfgs> Mean deviation     0.1368320521     Decreasing QCI force constant to      2.458633411    
 intlbfgs> largest atomic distance between images is     0.8956638814     for atom     10 and images      2     3 total images=     1
 checkrep> number of active repulsions and total=      58      58
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.96205E-04 d,ref,cutoff=     1.4354         1.7205        0.28316     max grad=    0.61999E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219121542        0.1371530226    
 intlbfgs> Highest QCI image energy=    0.9620483012E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9620483012E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    100    0.9620483012E-04   -0.1000000000+201    0.6199861870E-01     0.000000000        0.1299838414E-04        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.8956632095     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.95248E-04 d,ref,cutoff=     1.4354         1.7205        0.28316     max grad=    0.61688E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219121702        0.1370778856    
 intlbfgs> Highest QCI image energy=    0.9524811838E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9524811838E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    101    0.9524811838E-04   -0.1000000000+201    0.6168764921E-01     0.000000000        0.7996182132E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956645695     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.94471E-04 d,ref,cutoff=     1.4354         1.7205        0.28316     max grad=    0.61434E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219121829        0.1371896428    
 intlbfgs> Highest QCI image energy=    0.9447126715E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9447126715E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    102    0.9447126715E-04   -0.1000000000+201    0.6143368340E-01     0.000000000        0.6633136034E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956635208     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.94476E-04 d,ref,cutoff=     1.4354         1.7205        0.28316     max grad=    0.61435E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219121830        0.1370964634    
 intlbfgs> Highest QCI image energy=    0.9447619591E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9447619591E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    103    0.9447619591E-04   -0.1000000000+201    0.6143547395E-01     0.000000000        0.3689840188E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956636620     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.94480E-04 d,ref,cutoff=     1.4354         1.7205        0.28316     max grad=    0.61437E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219121829        0.1371310591    
 intlbfgs> Highest QCI image energy=    0.9447970559E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9447970559E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    104    0.9447970559E-04   -0.1000000000+201    0.6143660599E-01     0.000000000        0.1538211424E-05        15     3
 intlbfgs> Mean deviation     0.1371310591     Decreasing QCI force constant to      2.434290506    
 intlbfgs> largest atomic distance between images is     0.8956636552     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.94480E-04 d,ref,cutoff=     1.4354         1.7205        0.28316     max grad=    0.61437E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219121829        0.1371310993    
 intlbfgs> Highest QCI image energy=    0.9448007954E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9448007954E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    105    0.9448007954E-04   -0.1000000000+201    0.6143672950E-01     0.000000000        0.3069586264E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8956636242     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.94480E-04 d,ref,cutoff=     1.4354         1.7205        0.28316     max grad=    0.61437E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219121829        0.1371317572    
 intlbfgs> Highest QCI image energy=    0.9447970321E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9447970321E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    106    0.9447970321E-04   -0.1000000000+201    0.6143661172E-01     0.000000000        0.1644532747E-06        15     3
 intlbfgs> largest atomic distance between images is     0.8956753384     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.93237E-04 d,ref,cutoff=     1.4354         1.7205        0.28316     max grad=    0.61027E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219122021        0.1381111078    
 intlbfgs> Highest QCI image energy=    0.9323722336E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9323722336E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    107    0.9323722336E-04   -0.1000000000+201    0.6102702432E-01     0.000000000        0.2871657426E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956720767     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.93049E-04 d,ref,cutoff=     1.4354         1.7205        0.28316     max grad=    0.60966E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219122057        0.1378443561    
 intlbfgs> Highest QCI image energy=    0.9304925324E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9304925324E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    108    0.9304925324E-04   -0.1000000000+201    0.6096557452E-01     0.000000000        0.9408589413E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956658625     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.92720E-04 d,ref,cutoff=     1.4354         1.7205        0.28316     max grad=    0.60858E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219122121        0.1373077751    
 intlbfgs> Highest QCI image energy=    0.9272032210E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9272032210E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    109    0.9272032210E-04   -0.1000000000+201    0.6085794214E-01     0.000000000        0.1802622459E-04        15     3
 intlbfgs> Mean deviation     0.1373077751     Decreasing QCI force constant to      2.410188620    
 intlbfgs> largest atomic distance between images is     0.8956656394     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.92719E-04 d,ref,cutoff=     1.4354         1.7205        0.28316     max grad=    0.60858E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219122121        0.1372884654    
 intlbfgs> Highest QCI image energy=    0.9271902451E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9271902451E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    110    0.9271902451E-04   -0.1000000000+201    0.6085752699E-01     0.000000000        0.4992424624E-06        15     3
 intlbfgs> largest atomic distance between images is     0.8954477323     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.92591E-04 d,ref,cutoff=     1.4354         1.7205        0.28316     max grad=    0.60829E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219122532        0.1184454096    
 intlbfgs> Highest QCI image energy=    0.9259125075E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9259125075E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    111    0.9259125075E-04   -0.1000000000+201    0.6082850820E-01     0.000000000        0.4860631637E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956644642     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.92719E-04 d,ref,cutoff=     1.4354         1.7205        0.28316     max grad=    0.60858E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219122123        0.1371959758    
 intlbfgs> Highest QCI image energy=    0.9271946174E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9271946174E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    112    0.9271946174E-04   -0.1000000000+201    0.6085771388E-01     0.000000000        0.4828992236E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956628875     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.92720E-04 d,ref,cutoff=     1.4354         1.7205        0.28316     max grad=    0.60858E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219122125        0.1370576192    
 intlbfgs> Highest QCI image energy=    0.9272030267E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9272030267E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    113    0.9272030267E-04   -0.1000000000+201    0.6085824921E-01     0.000000000        0.5229947897E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956643033     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.92721E-04 d,ref,cutoff=     1.4354         1.7205        0.28316     max grad=    0.60858E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219122123        0.1371819868    
 intlbfgs> Highest QCI image energy=    0.9272055137E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9272055137E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    114    0.9272055137E-04   -0.1000000000+201    0.6085809969E-01     0.000000000        0.4715017714E-05        15     3
 intlbfgs> Mean deviation     0.1371819868     Decreasing QCI force constant to      2.386325366    
 intlbfgs> largest atomic distance between images is     0.8956878361     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.57508E-04 d,ref,cutoff=     1.4358         1.7205        0.28316     max grad=    0.47860E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219128767        0.1391212540    
 intlbfgs> Highest QCI image energy=    0.5750770136E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5750770136E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    115    0.5750770136E-04   -0.1000000000+201    0.4785965664E-01     0.000000000        0.2881715039E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956652450     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.90898E-04 d,ref,cutoff=     1.4354         1.7205        0.28316     max grad=    0.60253E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219122430        0.1372589283    
 intlbfgs> Highest QCI image energy=    0.9089795947E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9089795947E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    116    0.9089795947E-04   -0.1000000000+201    0.6025299662E-01     0.000000000        0.2747886847E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956661899     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.89277E-04 d,ref,cutoff=     1.4355         1.7205        0.28316     max grad=    0.59710E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219122706        0.1373367214    
 intlbfgs> Highest QCI image energy=    0.8927713949E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8927713949E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    117    0.8927713949E-04   -0.1000000000+201    0.5970981810E-01     0.000000000        0.1201874519E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956661776     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.89280E-04 d,ref,cutoff=     1.4355         1.7205        0.28316     max grad=    0.59711E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219122706        0.1373356978    
 intlbfgs> Highest QCI image energy=    0.8928011722E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8928011722E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    118    0.8928011722E-04   -0.1000000000+201    0.5971082114E-01     0.000000000        0.3212498709E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8956661475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.89283E-04 d,ref,cutoff=     1.4355         1.7205        0.28316     max grad=    0.59712E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219122705        0.1373331956    
 intlbfgs> Highest QCI image energy=    0.8928261682E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8928261682E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    119    0.8928261682E-04   -0.1000000000+201    0.5971166439E-01     0.000000000        0.6435323843E-07        15     3
 intlbfgs> Mean deviation     0.1373331956     Decreasing QCI force constant to      2.362698382    
 intlbfgs> largest atomic distance between images is     0.8956660666     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.89285E-04 d,ref,cutoff=     1.4355         1.7205        0.28316     max grad=    0.59712E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219122705        0.1373264714    
 intlbfgs> Highest QCI image energy=    0.8928490479E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8928490479E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    120    0.8928490479E-04   -0.1000000000+201    0.5971243965E-01     0.000000000        0.1708592555E-06        15     3
 intlbfgs> largest atomic distance between images is     0.8956657434     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.89283E-04 d,ref,cutoff=     1.4355         1.7205        0.28316     max grad=    0.59712E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219122706        0.1372995859    
 intlbfgs> Highest QCI image energy=    0.8928257637E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8928257637E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    121    0.8928257637E-04   -0.1000000000+201    0.5971167676E-01     0.000000000        0.6911330132E-06        15     3
 intlbfgs> largest atomic distance between images is     0.8956630232     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.89097E-04 d,ref,cutoff=     1.4355         1.7205        0.28316     max grad=    0.59649E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219122742        0.1370759909    
 intlbfgs> Highest QCI image energy=    0.8909701593E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8909701593E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    122    0.8909701593E-04   -0.1000000000+201    0.5964936264E-01     0.000000000        0.6075094615E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956588297     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.88011E-04 d,ref,cutoff=     1.4355         1.7205        0.28316     max grad=    0.59283E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219122935        0.1367424318    
 intlbfgs> Highest QCI image energy=    0.8801090507E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8801090507E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    123    0.8801090507E-04   -0.1000000000+201    0.5928257805E-01     0.000000000        0.1266155261E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956628790     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.87664E-04 d,ref,cutoff=     1.4355         1.7205        0.28316     max grad=    0.59165E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219122989        0.1370833820    
 intlbfgs> Highest QCI image energy=    0.8766375813E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8766375813E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    124    0.8766375813E-04   -0.1000000000+201    0.5916453035E-01     0.000000000        0.8788527076E-05        15     3
 intlbfgs> Mean deviation     0.1370833820     Decreasing QCI force constant to      2.339305329    
 intlbfgs> largest atomic distance between images is     0.8956666624     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.87618E-04 d,ref,cutoff=     1.4355         1.7205        0.28316     max grad=    0.59149E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219122992        0.1373956380    
 intlbfgs> Highest QCI image energy=    0.8761798712E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8761798712E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    125    0.8761798712E-04   -0.1000000000+201    0.5914874397E-01     0.000000000        0.7975154853E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8963651640     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.82005E-04 d,ref,cutoff=     1.4355         1.7205        0.28316     max grad=    0.57168E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219123697        0.1950042457    
 intlbfgs> Highest QCI image energy=    0.8200489574E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8200489574E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    126    0.8200489574E-04   -0.1000000000+201    0.5716802664E-01     0.000000000        0.1473482355E-02        15     3
 intlbfgs> largest atomic distance between images is     0.8956705147     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.87603E-04 d,ref,cutoff=     1.4355         1.7205        0.28316     max grad=    0.59143E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219122989        0.1376975344    
 intlbfgs> Highest QCI image energy=    0.8760299397E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8760299397E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    127    0.8760299397E-04   -0.1000000000+201    0.5914341869E-01     0.000000000        0.1465638485E-02        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.8956704712     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.87589E-04 d,ref,cutoff=     1.4355         1.7205        0.28316     max grad=    0.59139E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219122992        0.1376944001    
 intlbfgs> Highest QCI image energy=    0.8758908257E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8758908257E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    128    0.8758908257E-04   -0.1000000000+201    0.5913869442E-01     0.000000000        0.1488478653E-06        15     3
 intlbfgs> largest atomic distance between images is     0.8956668780     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.85983E-04 d,ref,cutoff=     1.4355         1.7205        0.28316     max grad=    0.58591E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219123276        0.1374478751    
 intlbfgs> Highest QCI image energy=    0.8598278237E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8598278237E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    129    0.8598278237E-04   -0.1000000000+201    0.5859059598E-01     0.000000000        0.1540307706E-04        15     3
 intlbfgs> Mean deviation     0.1374478751     Decreasing QCI force constant to      2.316143890    
 intlbfgs> largest atomic distance between images is     0.8956669223     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.85981E-04 d,ref,cutoff=     1.4355         1.7205        0.28316     max grad=    0.58590E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219123276        0.1374485665    
 intlbfgs> Highest QCI image energy=    0.8598118898E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8598118898E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    130    0.8598118898E-04   -0.1000000000+201    0.5859005018E-01     0.000000000        0.2852674566E-06        15     3
 intlbfgs> largest atomic distance between images is     0.8956886239     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.85960E-04 d,ref,cutoff=     1.4355         1.7205        0.28316     max grad=    0.58583E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219123283        0.1377570253    
 intlbfgs> Highest QCI image energy=    0.8596035534E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8596035534E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    131    0.8596035534E-04   -0.1000000000+201    0.5858321336E-01     0.000000000        0.1423878380E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956673075     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.85982E-04 d,ref,cutoff=     1.4355         1.7205        0.28316     max grad=    0.58590E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219123277        0.1374227866    
 intlbfgs> Highest QCI image energy=    0.8598196900E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8598196900E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    132    0.8598196900E-04   -0.1000000000+201    0.5859035967E-01     0.000000000        0.1369020331E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.8956670614     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.85980E-04 d,ref,cutoff=     1.4355         1.7205        0.28316     max grad=    0.58590E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219123277        0.1374020553    
 intlbfgs> Highest QCI image energy=    0.8598041421E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8598041421E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    133    0.8598041421E-04   -0.1000000000+201    0.5858984190E-01     0.000000000        0.5418039375E-06        15     3
 intlbfgs> largest atomic distance between images is     0.8956646921     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.85952E-04 d,ref,cutoff=     1.4355         1.7205        0.28316     max grad=    0.58580E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219123286        0.1372020070    
 intlbfgs> Highest QCI image energy=    0.8595228503E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8595228503E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    134    0.8595228503E-04   -0.1000000000+201    0.5858034551E-01     0.000000000        0.5197237633E-05        15     3
 intlbfgs> Mean deviation     0.1372020070     Decreasing QCI force constant to      2.293211772    
 intlbfgs> largest atomic distance between images is     0.8957349959     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.67540E-04 d,ref,cutoff=     1.4357         1.7205        0.28316     max grad=    0.51887E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219126624        0.1431434037    
 intlbfgs> Highest QCI image energy=    0.6753985747E-04 images=       1
 intlbfgs> Highest image        2 energy     0.6753985747E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    135    0.6753985747E-04   -0.1000000000+201    0.5188657856E-01     0.000000000        0.2008245246E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956682788     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.84215E-04 d,ref,cutoff=     1.4355         1.7205        0.28316     max grad=    0.57981E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219123587        0.1375058025    
 intlbfgs> Highest QCI image energy=    0.8421512272E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8421512272E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    136    0.8421512272E-04   -0.1000000000+201    0.5798135884E-01     0.000000000        0.1868838789E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956688759     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.82777E-04 d,ref,cutoff=     1.4355         1.7205        0.28316     max grad=    0.57481E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219123842        0.1375564680    
 intlbfgs> Highest QCI image energy=    0.8277741389E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8277741389E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    137    0.8277741389E-04   -0.1000000000+201    0.5748114946E-01     0.000000000        0.1106932137E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956688395     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.82778E-04 d,ref,cutoff=     1.4355         1.7205        0.28316     max grad=    0.57481E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219123842        0.1375532639    
 intlbfgs> Highest QCI image energy=    0.8277817859E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8277817859E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    138    0.8277817859E-04   -0.1000000000+201    0.5748141890E-01     0.000000000        0.8731072749E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8956688565     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.82778E-04 d,ref,cutoff=     1.4355         1.7205        0.28316     max grad=    0.57481E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219123842        0.1375537501    
 intlbfgs> Highest QCI image energy=    0.8277822481E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8277822481E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    139    0.8277822481E-04   -0.1000000000+201    0.5748143407E-01     0.000000000        0.8131240161E-07        15     3
 intlbfgs> Mean deviation     0.1375537501     Decreasing QCI force constant to      2.270506705    
 intlbfgs> largest atomic distance between images is     0.8956689209     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.82778E-04 d,ref,cutoff=     1.4355         1.7205        0.28316     max grad=    0.57481E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219123842        0.1375572102    
 intlbfgs> Highest QCI image energy=    0.8277818807E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8277818807E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    140    0.8277818807E-04   -0.1000000000+201    0.5748141743E-01     0.000000000        0.1664047815E-06        15     3
 intlbfgs> largest atomic distance between images is     0.8976293042     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.81111E-04 d,ref,cutoff=     1.4355         1.7205        0.28316     max grad=    0.56781E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219131984        0.2427852172    
 intlbfgs> Highest QCI image energy=    0.8111081854E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8111081854E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    141    0.8111081854E-04   -0.1000000000+201    0.5678091592E-01     0.000000000        0.5063120703E-02        15     3
 intlbfgs> largest atomic distance between images is     0.8956689924     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.82778E-04 d,ref,cutoff=     1.4355         1.7205        0.28316     max grad=    0.57481E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219123842        0.1375612798    
 intlbfgs> Highest QCI image energy=    0.8277819953E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8277819953E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    142    0.8277819953E-04   -0.1000000000+201    0.5748141720E-01     0.000000000        0.5062952607E-02        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.8956689984     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.82778E-04 d,ref,cutoff=     1.4355         1.7205        0.28316     max grad=    0.57481E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219123842        0.1375618105    
 intlbfgs> Highest QCI image energy=    0.8277817542E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8277817542E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    143    0.8277817542E-04   -0.1000000000+201    0.5748140840E-01     0.000000000        0.1464604897E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8956704739     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.82767E-04 d,ref,cutoff=     1.4355         1.7205        0.28316     max grad=    0.57477E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219123842        0.1376914467    
 intlbfgs> Highest QCI image energy=    0.8276684269E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8276684269E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    144    0.8276684269E-04   -0.1000000000+201    0.5747735666E-01     0.000000000        0.3556414051E-05        15     3
 intlbfgs> Mean deviation     0.1376914467     Decreasing QCI force constant to      2.248026441    
 intlbfgs> largest atomic distance between images is     0.8956292306     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.57744E-04 d,ref,cutoff=     1.4358         1.7205        0.28316     max grad=    0.47961E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219128804        0.1341407435    
 intlbfgs> Highest QCI image energy=    0.5774364845E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5774364845E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    145    0.5774364845E-04   -0.1000000000+201    0.4796131717E-01     0.000000000        0.2425897990E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956696760     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.81131E-04 d,ref,cutoff=     1.4355         1.7205        0.28316     max grad=    0.56903E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219124137        0.1376179767    
 intlbfgs> Highest QCI image energy=    0.8113122113E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8113122113E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    146    0.8113122113E-04   -0.1000000000+201    0.5690310157E-01     0.000000000        0.2297582026E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956701041     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79701E-04 d,ref,cutoff=     1.4356         1.7205        0.28316     max grad=    0.56396E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219124396        0.1376595133    
 intlbfgs> Highest QCI image energy=    0.7970115385E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7970115385E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    147    0.7970115385E-04   -0.1000000000+201    0.5639624175E-01     0.000000000        0.1123803761E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956701367     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79703E-04 d,ref,cutoff=     1.4356         1.7205        0.28316     max grad=    0.56397E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219124396        0.1376620158    
 intlbfgs> Highest QCI image energy=    0.7970282936E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7970282936E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    148    0.7970282936E-04   -0.1000000000+201    0.5639683626E-01     0.000000000        0.6408888770E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8956702519     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79705E-04 d,ref,cutoff=     1.4356         1.7205        0.28316     max grad=    0.56397E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219124395        0.1376704434    
 intlbfgs> Highest QCI image energy=    0.7970454887E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7970454887E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    149    0.7970454887E-04   -0.1000000000+201    0.5639744166E-01     0.000000000        0.2120436214E-06        15     3
 intlbfgs> Mean deviation     0.1376704434     Decreasing QCI force constant to      2.225768753    
 intlbfgs> largest atomic distance between images is     0.8956703503     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79704E-04 d,ref,cutoff=     1.4356         1.7205        0.28316     max grad=    0.56397E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219124395        0.1376759052    
 intlbfgs> Highest QCI image energy=    0.7970373820E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7970373820E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    150    0.7970373820E-04   -0.1000000000+201    0.5639714775E-01     0.000000000        0.2479057789E-06        15     3
 intlbfgs> largest atomic distance between images is     0.8956787937     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79702E-04 d,ref,cutoff=     1.4356         1.7205        0.28316     max grad=    0.56396E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219124388        0.1381499556    
 intlbfgs> Highest QCI image energy=    0.7970223232E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7970223232E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    151    0.7970223232E-04   -0.1000000000+201    0.5639615215E-01     0.000000000        0.2091312431E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956690653     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79702E-04 d,ref,cutoff=     1.4356         1.7205        0.28316     max grad=    0.56397E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219124397        0.1375530651    
 intlbfgs> Highest QCI image energy=    0.7970208853E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7970208853E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    152    0.7970208853E-04   -0.1000000000+201    0.5639664153E-01     0.000000000        0.2090585418E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956719545     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79707E-04 d,ref,cutoff=     1.4356         1.7205        0.28316     max grad=    0.56398E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219124392        0.1378341987    
 intlbfgs> Highest QCI image energy=    0.7970735084E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7970735084E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    153    0.7970735084E-04   -0.1000000000+201    0.5639833216E-01     0.000000000        0.9088585512E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956699975     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79701E-04 d,ref,cutoff=     1.4356         1.7205        0.28316     max grad=    0.56396E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219124396        0.1376366848    
 intlbfgs> Highest QCI image energy=    0.7970078910E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7970078910E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    154    0.7970078910E-04   -0.1000000000+201    0.5639612186E-01     0.000000000        0.6761325276E-05        15     3
 intlbfgs> Mean deviation     0.1376366848     Decreasing QCI force constant to      2.203731439    
 intlbfgs> largest atomic distance between images is     0.8957016797     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.48798E-04 d,ref,cutoff=     1.4359         1.7205        0.28316     max grad=    0.44068E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219130710        0.1404632475    
 intlbfgs> Highest QCI image energy=    0.4879828979E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4879828979E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    155    0.4879828979E-04   -0.1000000000+201    0.4406797365E-01     0.000000000        0.2777892235E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956711135     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.78137E-04 d,ref,cutoff=     1.4356         1.7205        0.28316     max grad=    0.55837E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219124682        0.1377347610    
 intlbfgs> Highest QCI image energy=    0.7813666200E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7813666200E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    156    0.7813666200E-04   -0.1000000000+201    0.5583653686E-01     0.000000000        0.2653674995E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956718279     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.76736E-04 d,ref,cutoff=     1.4356         1.7205        0.28316     max grad=    0.55331E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219124940        0.1377917381    
 intlbfgs> Highest QCI image energy=    0.7673619000E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7673619000E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    157    0.7673619000E-04   -0.1000000000+201    0.5533080772E-01     0.000000000        0.1119719974E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956718197     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.76739E-04 d,ref,cutoff=     1.4356         1.7205        0.28316     max grad=    0.55332E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219124940        0.1377909914    
 intlbfgs> Highest QCI image energy=    0.7673863983E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7673863983E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    158    0.7673863983E-04   -0.1000000000+201    0.5533169675E-01     0.000000000        0.2780644748E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8956718180     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.76739E-04 d,ref,cutoff=     1.4356         1.7205        0.28316     max grad=    0.55332E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219124939        0.1377908706    
 intlbfgs> Highest QCI image energy=    0.7673870692E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7673870692E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    159    0.7673870692E-04   -0.1000000000+201    0.5533172117E-01     0.000000000        0.3898472859E-08        15     3
 intlbfgs> Mean deviation     0.1377908706     Decreasing QCI force constant to      2.181912316    
 intlbfgs> largest atomic distance between images is     0.8956717887     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.76739E-04 d,ref,cutoff=     1.4356         1.7205        0.28316     max grad=    0.55332E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219124939        0.1377889784    
 intlbfgs> Highest QCI image energy=    0.7673893958E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7673893958E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    160    0.7673893958E-04   -0.1000000000+201    0.5533180680E-01     0.000000000        0.6820526119E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8956706243     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.76739E-04 d,ref,cutoff=     1.4356         1.7205        0.28316     max grad=    0.55332E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219124941        0.1377143890    
 intlbfgs> Highest QCI image energy=    0.7673862498E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7673862498E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    161    0.7673862498E-04   -0.1000000000+201    0.5533174198E-01     0.000000000        0.2763346921E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956718455     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.76738E-04 d,ref,cutoff=     1.4356         1.7205        0.28316     max grad=    0.55331E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219124940        0.1378004724    
 intlbfgs> Highest QCI image energy=    0.7673767088E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7673767088E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    162    0.7673767088E-04   -0.1000000000+201    0.5533133984E-01     0.000000000        0.2594384760E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956726055     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.76727E-04 d,ref,cutoff=     1.4356         1.7205        0.28316     max grad=    0.55327E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219124940        0.1378848624    
 intlbfgs> Highest QCI image energy=    0.7672712350E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7672712350E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    163    0.7672712350E-04   -0.1000000000+201    0.5532746146E-01     0.000000000        0.3318209231E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956735066     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.76701E-04 d,ref,cutoff=     1.4356         1.7205        0.28316     max grad=    0.55318E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219124943        0.1379749842    
 intlbfgs> Highest QCI image energy=    0.7670104285E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7670104285E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    164    0.7670104285E-04   -0.1000000000+201    0.5531794218E-01     0.000000000        0.3033633536E-05        15     3
 intlbfgs> Mean deviation     0.1379749842     Decreasing QCI force constant to      2.160309224    
 intlbfgs> largest atomic distance between images is     0.8956465537     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.67998E-04 d,ref,cutoff=     1.4357         1.7205        0.28316     max grad=    0.52068E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219126666        0.1351562822    
 intlbfgs> Highest QCI image energy=    0.6799801662E-04 images=       1
 intlbfgs> Highest image        2 energy     0.6799801662E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    165    0.6799801662E-04   -0.1000000000+201    0.5206837906E-01     0.000000000        0.1308937776E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956725353     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.75033E-04 d,ref,cutoff=     1.4356         1.7205        0.28316     max grad=    0.54709E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219125258        0.1378469640    
 intlbfgs> Highest QCI image energy=    0.7503254256E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7503254256E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    166    0.7503254256E-04   -0.1000000000+201    0.5470941860E-01     0.000000000        0.1175569948E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956732334     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.73882E-04 d,ref,cutoff=     1.4356         1.7205        0.28316     max grad=    0.54286E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219125474        0.1379041083    
 intlbfgs> Highest QCI image energy=    0.7388244961E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7388244961E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    167    0.7388244961E-04   -0.1000000000+201    0.5428597084E-01     0.000000000        0.9383131537E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956732498     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.73882E-04 d,ref,cutoff=     1.4356         1.7205        0.28316     max grad=    0.54286E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219125474        0.1379058661    
 intlbfgs> Highest QCI image energy=    0.7388227571E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7388227571E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    168    0.7388227571E-04   -0.1000000000+201    0.5428590569E-01     0.000000000        0.6534664445E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8956731989     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.73882E-04 d,ref,cutoff=     1.4356         1.7205        0.28316     max grad=    0.54286E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219125475        0.1379028350    
 intlbfgs> Highest QCI image energy=    0.7388223289E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7388223289E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    169    0.7388223289E-04   -0.1000000000+201    0.5428589617E-01     0.000000000        0.1040717215E-06        15     3
 intlbfgs> Mean deviation     0.1379028350     Decreasing QCI force constant to      2.138920023    
 intlbfgs> largest atomic distance between images is     0.8956731832     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.73882E-04 d,ref,cutoff=     1.4356         1.7205        0.28316     max grad=    0.54286E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219125475        0.1379018705    
 intlbfgs> Highest QCI image energy=    0.7388227164E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7388227164E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    170    0.7388227164E-04   -0.1000000000+201    0.5428591237E-01     0.000000000        0.3003940042E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8956678082     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.73882E-04 d,ref,cutoff=     1.4356         1.7205        0.28316     max grad=    0.54286E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219125480        0.1375703126    
 intlbfgs> Highest QCI image energy=    0.7388209475E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7388209475E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    171    0.7388209475E-04   -0.1000000000+201    0.5428649295E-01     0.000000000        0.1034309512E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956732709     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.73882E-04 d,ref,cutoff=     1.4356         1.7205        0.28316     max grad=    0.54286E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219125474        0.1379120462    
 intlbfgs> Highest QCI image energy=    0.7388194472E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7388194472E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    172    0.7388194472E-04   -0.1000000000+201    0.5428578814E-01     0.000000000        0.1031465174E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956732039     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.73882E-04 d,ref,cutoff=     1.4356         1.7205        0.28316     max grad=    0.54286E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219125475        0.1379031161    
 intlbfgs> Highest QCI image energy=    0.7388161059E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7388161059E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    173    0.7388161059E-04   -0.1000000000+201    0.5428566574E-01     0.000000000        0.4283737603E-06        15     3
 intlbfgs> largest atomic distance between images is     0.8956729189     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.73879E-04 d,ref,cutoff=     1.4356         1.7205        0.28316     max grad=    0.54285E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219125476        0.1378654596    
 intlbfgs> Highest QCI image energy=    0.7387852451E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7387852451E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    174    0.7387852451E-04   -0.1000000000+201    0.5428453015E-01     0.000000000        0.1793560183E-05        15     3
 intlbfgs> Mean deviation     0.1378654596     Decreasing QCI force constant to      2.117742597    
 intlbfgs> largest atomic distance between images is     0.8957012004     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.46371E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.42953E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219131285        0.1408561240    
 intlbfgs> Highest QCI image energy=    0.4637060821E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4637060821E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    175    0.4637060821E-04   -0.1000000000+201    0.4295309743E-01     0.000000000        0.2655952244E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956739112     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.72425E-04 d,ref,cutoff=     1.4356         1.7205        0.28316     max grad=    0.53745E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219125752        0.1379610270    
 intlbfgs> Highest QCI image energy=    0.7242519035E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7242519035E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    176    0.7242519035E-04   -0.1000000000+201    0.5374474391E-01     0.000000000        0.2536910863E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956745378     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.71128E-04 d,ref,cutoff=     1.4357         1.7205        0.28316     max grad=    0.53258E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219126001        0.1380120047    
 intlbfgs> Highest QCI image energy=    0.7112773222E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7112773222E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    177    0.7112773222E-04   -0.1000000000+201    0.5325831714E-01     0.000000000        0.1077702905E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956745318     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.71130E-04 d,ref,cutoff=     1.4357         1.7205        0.28316     max grad=    0.53259E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219126000        0.1380112102    
 intlbfgs> Highest QCI image energy=    0.7112976836E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7112976836E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    178    0.7112976836E-04   -0.1000000000+201    0.5325908393E-01     0.000000000        0.4054705802E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8956745328     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.71130E-04 d,ref,cutoff=     1.4357         1.7205        0.28316     max grad=    0.53259E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219126000        0.1380112683    
 intlbfgs> Highest QCI image energy=    0.7112978125E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7112978125E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    179    0.7112978125E-04   -0.1000000000+201    0.5325908867E-01     0.000000000        0.1799134856E-08        15     3
 intlbfgs> Mean deviation     0.1380112683     Decreasing QCI force constant to      2.096774849    
 intlbfgs> largest atomic distance between images is     0.8956745533     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.71130E-04 d,ref,cutoff=     1.4357         1.7205        0.28316     max grad=    0.53259E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219126000        0.1380125928    
 intlbfgs> Highest QCI image energy=    0.7112977024E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7112977024E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    180    0.7112977024E-04   -0.1000000000+201    0.5325908233E-01     0.000000000        0.3431142571E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8957693267     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.71126E-04 d,ref,cutoff=     1.4357         1.7205        0.28316     max grad=    0.53248E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219125906        0.1441175356    
 intlbfgs> Highest QCI image energy=    0.7112605716E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7112605716E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    181    0.7112605716E-04   -0.1000000000+201    0.5324753823E-01     0.000000000        0.1586314683E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956745843     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.71130E-04 d,ref,cutoff=     1.4357         1.7205        0.28316     max grad=    0.53259E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219126000        0.1380150783    
 intlbfgs> Highest QCI image energy=    0.7112978010E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7112978010E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    182    0.7112978010E-04   -0.1000000000+201    0.5325908338E-01     0.000000000        0.1585960694E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.8956746000     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.71130E-04 d,ref,cutoff=     1.4357         1.7205        0.28316     max grad=    0.53259E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219126000        0.1380168792    
 intlbfgs> Highest QCI image energy=    0.7112976916E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7112976916E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    183    0.7112976916E-04   -0.1000000000+201    0.5325907862E-01     0.000000000        0.7273453524E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8956746508     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.71130E-04 d,ref,cutoff=     1.4357         1.7205        0.28316     max grad=    0.53259E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219126000        0.1380227533    
 intlbfgs> Highest QCI image energy=    0.7112957630E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7112957630E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    184    0.7112957630E-04   -0.1000000000+201    0.5325900401E-01     0.000000000        0.2405601920E-06        15     3
 intlbfgs> Mean deviation     0.1380227533     Decreasing QCI force constant to      2.076014702    
 intlbfgs> largest atomic distance between images is     0.8956809244     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.41998E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.40869E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219132414        0.1382117386    
 intlbfgs> Highest QCI image energy=    0.4199815347E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4199815347E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    185    0.4199815347E-04   -0.1000000000+201    0.4086892699E-01     0.000000000        0.2787392005E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956752578     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.69732E-04 d,ref,cutoff=     1.4357         1.7205        0.28316     max grad=    0.52730E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219126272        0.1380693958    
 intlbfgs> Highest QCI image energy=    0.6973200540E-04 images=       1
 intlbfgs> Highest image        2 energy     0.6973200540E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    186    0.6973200540E-04   -0.1000000000+201    0.5273012244E-01     0.000000000        0.2671167829E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956758665     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.68475E-04 d,ref,cutoff=     1.4357         1.7205        0.28316     max grad=    0.52250E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219126518        0.1381191208    
 intlbfgs> Highest QCI image energy=    0.6847525357E-04 images=       1
 intlbfgs> Highest image        2 energy     0.6847525357E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    187    0.6847525357E-04   -0.1000000000+201    0.5225003810E-01     0.000000000        0.1064013886E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956758704     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.68477E-04 d,ref,cutoff=     1.4357         1.7205        0.28316     max grad=    0.52251E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219126517        0.1381195391    
 intlbfgs> Highest QCI image energy=    0.6847748780E-04 images=       1
 intlbfgs> Highest image        2 energy     0.6847748780E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    188    0.6847748780E-04   -0.1000000000+201    0.5225089517E-01     0.000000000        0.2593016053E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8956758717     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.68478E-04 d,ref,cutoff=     1.4357         1.7205        0.28316     max grad=    0.52251E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219126517        0.1381196285    
 intlbfgs> Highest QCI image energy=    0.6847751090E-04 images=       1
 intlbfgs> Highest image        2 energy     0.6847751090E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    189    0.6847751090E-04   -0.1000000000+201    0.5225090390E-01     0.000000000        0.2114321075E-08        15     3
 intlbfgs> Mean deviation     0.1381196285     Decreasing QCI force constant to      2.055460101    
 intlbfgs> largest atomic distance between images is     0.8956759010     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.68478E-04 d,ref,cutoff=     1.4357         1.7205        0.28316     max grad=    0.52251E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219126517        0.1381215672    
 intlbfgs> Highest QCI image energy=    0.6847755868E-04 images=       1
 intlbfgs> Highest image        2 energy     0.6847755868E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    190    0.6847755868E-04   -0.1000000000+201    0.5225091924E-01     0.000000000        0.4723885723E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8956878674     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.68477E-04 d,ref,cutoff=     1.4357         1.7205        0.28316     max grad=    0.52250E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219126504        0.1389110220    
 intlbfgs> Highest QCI image energy=    0.6847711785E-04 images=       1
 intlbfgs> Highest image        2 energy     0.6847711785E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    191    0.6847711785E-04   -0.1000000000+201    0.5224952790E-01     0.000000000        0.1928992437E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956759258     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.68478E-04 d,ref,cutoff=     1.4357         1.7205        0.28316     max grad=    0.52251E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219126517        0.1381225725    
 intlbfgs> Highest QCI image energy=    0.6847750054E-04 images=       1
 intlbfgs> Highest image        2 energy     0.6847750054E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    192    0.6847750054E-04   -0.1000000000+201    0.5225089359E-01     0.000000000        0.1923427866E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956758521     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.68477E-04 d,ref,cutoff=     1.4357         1.7205        0.28316     max grad=    0.52251E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219126518        0.1381132307    
 intlbfgs> Highest QCI image energy=    0.6847732527E-04 images=       1
 intlbfgs> Highest image        2 energy     0.6847732527E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    193    0.6847732527E-04   -0.1000000000+201    0.5225082814E-01     0.000000000        0.4257061511E-06        15     3
 intlbfgs> largest atomic distance between images is     0.8956757568     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.68477E-04 d,ref,cutoff=     1.4357         1.7205        0.28316     max grad=    0.52251E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219126518        0.1381015698    
 intlbfgs> Highest QCI image energy=    0.6847664820E-04 images=       1
 intlbfgs> Highest image        2 energy     0.6847664820E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    194    0.6847664820E-04   -0.1000000000+201    0.5225057116E-01     0.000000000        0.5106743873E-06        15     3
 intlbfgs> Mean deviation     0.1381015698     Decreasing QCI force constant to      2.035109011    
 intlbfgs> largest atomic distance between images is     0.8957042315     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.41245E-04 d,ref,cutoff=     1.4361         1.7205        0.28316     max grad=    0.40499E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219132561        0.1409858394    
 intlbfgs> Highest QCI image energy=    0.4124489829E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4124489829E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    195    0.4124489829E-04   -0.1000000000+201    0.4049852953E-01     0.000000000        0.2711187135E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956766008     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.67129E-04 d,ref,cutoff=     1.4357         1.7205        0.28316     max grad=    0.51731E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219126784        0.1381783190    
 intlbfgs> Highest QCI image energy=    0.6712886539E-04 images=       1
 intlbfgs> Highest image        2 energy     0.6712886539E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    196    0.6712886539E-04   -0.1000000000+201    0.5173084742E-01     0.000000000        0.2597610541E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956771895     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.65920E-04 d,ref,cutoff=     1.4357         1.7205        0.28316     max grad=    0.51260E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219127026        0.1382264750    
 intlbfgs> Highest QCI image energy=    0.6591989837E-04 images=       1
 intlbfgs> Highest image        2 energy     0.6591989837E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    197    0.6591989837E-04   -0.1000000000+201    0.5126025205E-01     0.000000000        0.1043330886E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956771845     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.65922E-04 d,ref,cutoff=     1.4357         1.7205        0.28316     max grad=    0.51261E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219127025        0.1382258204    
 intlbfgs> Highest QCI image energy=    0.6592190706E-04 images=       1
 intlbfgs> Highest image        2 energy     0.6592190706E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    198    0.6592190706E-04   -0.1000000000+201    0.5126103747E-01     0.000000000        0.3444196536E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8956771860     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.65922E-04 d,ref,cutoff=     1.4357         1.7205        0.28316     max grad=    0.51261E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219127025        0.1382259101    
 intlbfgs> Highest QCI image energy=    0.6592193852E-04 images=       1
 intlbfgs> Highest image        2 energy     0.6592193852E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    199    0.6592193852E-04   -0.1000000000+201    0.5126104961E-01     0.000000000        0.2888909836E-08        15     3
 intlbfgs> Mean deviation     0.1382259101     Decreasing QCI force constant to      2.014959417    
 intlbfgs> largest atomic distance between images is     0.8956772194     for atom     10 and images      2     3 total images=     1
 checkrep> number of active repulsions and total=      58      58
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.65922E-04 d,ref,cutoff=     1.4357         1.7205        0.28316     max grad=    0.51261E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219127025        0.1382280078    
 intlbfgs> Highest QCI image energy=    0.6592199088E-04 images=       1
 intlbfgs> Highest image        2 energy     0.6592199088E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    200    0.6592199088E-04   -0.1000000000+201    0.5126106673E-01     0.000000000        0.5531302665E-07        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.8956908043     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.65921E-04 d,ref,cutoff=     1.4357         1.7205        0.28316     max grad=    0.51259E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219127011        0.1390857154    
 intlbfgs> Highest QCI image energy=    0.6592141558E-04 images=       1
 intlbfgs> Highest image        2 energy     0.6592141558E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    201    0.6592141558E-04   -0.1000000000+201    0.5125948280E-01     0.000000000        0.2239492370E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956773215     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.65922E-04 d,ref,cutoff=     1.4357         1.7205        0.28316     max grad=    0.51261E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219127025        0.1382368921    
 intlbfgs> Highest QCI image energy=    0.6592192411E-04 images=       1
 intlbfgs> Highest image        2 energy     0.6592192411E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    202    0.6592192411E-04   -0.1000000000+201    0.5126103335E-01     0.000000000        0.2232862160E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956773707     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.65922E-04 d,ref,cutoff=     1.4357         1.7205        0.28316     max grad=    0.51261E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219127025        0.1382420124    
 intlbfgs> Highest QCI image energy=    0.6592181010E-04 images=       1
 intlbfgs> Highest image        2 energy     0.6592181010E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    203    0.6592181010E-04   -0.1000000000+201    0.5126098628E-01     0.000000000        0.1798063771E-06        15     3
 intlbfgs> largest atomic distance between images is     0.8956776534     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.65919E-04 d,ref,cutoff=     1.4357         1.7205        0.28316     max grad=    0.51260E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219127025        0.1382729400    
 intlbfgs> Highest QCI image energy=    0.6591921286E-04 images=       1
 intlbfgs> Highest image        2 energy     0.6591921286E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    204    0.6591921286E-04   -0.1000000000+201    0.5125995862E-01     0.000000000        0.1172429875E-05        15     3
 intlbfgs> Mean deviation     0.1382729400     Decreasing QCI force constant to      1.995009323    
 intlbfgs> largest atomic distance between images is     0.8956631456     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.42505E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.41117E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219132320        0.1363726318    
 intlbfgs> Highest QCI image energy=    0.4250523442E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4250523442E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    205    0.4250523442E-04   -0.1000000000+201    0.4111671938E-01     0.000000000        0.2505338602E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956779033     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.64615E-04 d,ref,cutoff=     1.4357         1.7205        0.28316     max grad=    0.50748E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219127289        0.1382828150    
 intlbfgs> Highest QCI image energy=    0.6461518399E-04 images=       1
 intlbfgs> Highest image        2 energy     0.6461518399E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    206    0.6461518399E-04   -0.1000000000+201    0.5074756602E-01     0.000000000        0.2396382738E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956784381     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.63458E-04 d,ref,cutoff=     1.4357         1.7205        0.28316     max grad=    0.50289E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219127525        0.1383273351    
 intlbfgs> Highest QCI image energy=    0.6345806240E-04 images=       1
 intlbfgs> Highest image        2 energy     0.6345806240E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    207    0.6345806240E-04   -0.1000000000+201    0.5028858812E-01     0.000000000        0.1017978271E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956784519     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.63460E-04 d,ref,cutoff=     1.4357         1.7205        0.28316     max grad=    0.50289E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219127525        0.1383287401    
 intlbfgs> Highest QCI image energy=    0.6345962607E-04 images=       1
 intlbfgs> Highest image        2 energy     0.6345962607E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    208    0.6345962607E-04   -0.1000000000+201    0.5028921035E-01     0.000000000        0.5102694441E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8956784576     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.63460E-04 d,ref,cutoff=     1.4357         1.7205        0.28316     max grad=    0.50289E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219127525        0.1383291774    
 intlbfgs> Highest QCI image energy=    0.6345970762E-04 images=       1
 intlbfgs> Highest image        2 energy     0.6345970762E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    209    0.6345970762E-04   -0.1000000000+201    0.5028924235E-01     0.000000000        0.9665561849E-08        15     3
 intlbfgs> Mean deviation     0.1383291774     Decreasing QCI force constant to      1.975256756    
 intlbfgs> largest atomic distance between images is     0.8956785146     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.63460E-04 d,ref,cutoff=     1.4357         1.7205        0.28316     max grad=    0.50289E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219127525        0.1383331434    
 intlbfgs> Highest QCI image energy=    0.6345974310E-04 images=       1
 intlbfgs> Highest image        2 energy     0.6345974310E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    210    0.6345974310E-04   -0.1000000000+201    0.5028925100E-01     0.000000000        0.9109159734E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8957902156     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.63452E-04 d,ref,cutoff=     1.4357         1.7205        0.28316     max grad=    0.50275E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219127405        0.1460999535    
 intlbfgs> Highest QCI image energy=    0.6345157912E-04 images=       1
 intlbfgs> Highest image        2 energy     0.6345157912E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    211    0.6345157912E-04   -0.1000000000+201    0.5027523454E-01     0.000000000        0.1785936371E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956785602     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.63460E-04 d,ref,cutoff=     1.4357         1.7205        0.28316     max grad=    0.50289E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219127525        0.1383326534    
 intlbfgs> Highest QCI image energy=    0.6345969708E-04 images=       1
 intlbfgs> Highest image        2 energy     0.6345969708E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    212    0.6345969708E-04   -0.1000000000+201    0.5028922330E-01     0.000000000        0.1784795901E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956786414     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.63460E-04 d,ref,cutoff=     1.4357         1.7205        0.28316     max grad=    0.50289E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219127525        0.1383503799    
 intlbfgs> Highest QCI image energy=    0.6345968058E-04 images=       1
 intlbfgs> Highest image        2 energy     0.6345968058E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    213    0.6345968058E-04   -0.1000000000+201    0.5028922525E-01     0.000000000        0.1210086264E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956785847     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.63460E-04 d,ref,cutoff=     1.4357         1.7205        0.28316     max grad=    0.50289E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219127525        0.1383379786    
 intlbfgs> Highest QCI image energy=    0.6345964101E-04 images=       1
 intlbfgs> Highest image        2 energy     0.6345964101E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    214    0.6345964101E-04   -0.1000000000+201    0.5028920352E-01     0.000000000        0.8469292862E-06        15     3
 intlbfgs> Mean deviation     0.1383379786     Decreasing QCI force constant to      1.955699758    
 intlbfgs> largest atomic distance between images is     0.8956939834     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.35424E-04 d,ref,cutoff=     1.4361         1.7205        0.28316     max grad=    0.37520E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219134138        0.1396291352    
 intlbfgs> Highest QCI image energy=    0.3542426807E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3542426807E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    215    0.3542426807E-04   -0.1000000000+201    0.3752024234E-01     0.000000000        0.2838307204E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956791922     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.62214E-04 d,ref,cutoff=     1.4358         1.7205        0.28316     max grad=    0.49790E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219127781        0.1383873893    
 intlbfgs> Highest QCI image energy=    0.6221356457E-04 images=       1
 intlbfgs> Highest image        2 energy     0.6221356457E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    216    0.6221356457E-04   -0.1000000000+201    0.4979029175E-01     0.000000000        0.2727651661E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956797353     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.61085E-04 d,ref,cutoff=     1.4358         1.7205        0.28316     max grad=    0.49334E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219128016        0.1384319946    
 intlbfgs> Highest QCI image energy=    0.6108523817E-04 images=       1
 intlbfgs> Highest image        2 energy     0.6108523817E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    217    0.6108523817E-04   -0.1000000000+201    0.4933424623E-01     0.000000000        0.1011759847E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956797366     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.61087E-04 d,ref,cutoff=     1.4358         1.7205        0.28316     max grad=    0.49335E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219128016        0.1384320661    
 intlbfgs> Highest QCI image energy=    0.6108734113E-04 images=       1
 intlbfgs> Highest image        2 energy     0.6108734113E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    218    0.6108734113E-04   -0.1000000000+201    0.4933509982E-01     0.000000000        0.1940622454E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8956797391     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.61087E-04 d,ref,cutoff=     1.4358         1.7205        0.28316     max grad=    0.49335E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219128016        0.1384322389    
 intlbfgs> Highest QCI image energy=    0.6108742328E-04 images=       1
 intlbfgs> Highest image        2 energy     0.6108742328E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    219    0.6108742328E-04   -0.1000000000+201    0.4933513293E-01     0.000000000        0.4137523274E-08        15     3
 intlbfgs> Mean deviation     0.1384322389     Decreasing QCI force constant to      1.936336394    
 intlbfgs> largest atomic distance between images is     0.8956797863     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.61088E-04 d,ref,cutoff=     1.4358         1.7205        0.28316     max grad=    0.49335E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219128016        0.1384355155    
 intlbfgs> Highest QCI image energy=    0.6108786362E-04 images=       1
 intlbfgs> Highest image        2 energy     0.6108786362E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    220    0.6108786362E-04   -0.1000000000+201    0.4933530723E-01     0.000000000        0.7598801270E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8956802652     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.61087E-04 d,ref,cutoff=     1.4358         1.7205        0.28316     max grad=    0.49335E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219128015        0.1384688155    
 intlbfgs> Highest QCI image energy=    0.6108740153E-04 images=       1
 intlbfgs> Highest image        2 energy     0.6108740153E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    221    0.6108740153E-04   -0.1000000000+201    0.4933507434E-01     0.000000000        0.7654752698E-06        15     3
 intlbfgs> largest atomic distance between images is     0.8956807963     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.61074E-04 d,ref,cutoff=     1.4358         1.7205        0.28316     max grad=    0.49330E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219128017        0.1385065172    
 intlbfgs> Highest QCI image energy=    0.6107412647E-04 images=       1
 intlbfgs> Highest image        2 energy     0.6107412647E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    222    0.6107412647E-04   -0.1000000000+201    0.4932963574E-01     0.000000000        0.8399403309E-06        15     3
 intlbfgs> largest atomic distance between images is     0.8956912874     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.60416E-04 d,ref,cutoff=     1.4358         1.7205        0.28316     max grad=    0.49061E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219128143        0.1392731027    
 intlbfgs> Highest QCI image energy=    0.6041646356E-04 images=       1
 intlbfgs> Highest image        2 energy     0.6041646356E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    223    0.6041646356E-04   -0.1000000000+201    0.4906097103E-01     0.000000000        0.1724582617E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956882810     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.60074E-04 d,ref,cutoff=     1.4358         1.7205        0.28316     max grad=    0.48921E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219128218        0.1390821068    
 intlbfgs> Highest QCI image energy=    0.6007427030E-04 images=       1
 intlbfgs> Highest image        2 energy     0.6007427030E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    224    0.6007427030E-04   -0.1000000000+201    0.4892140574E-01     0.000000000        0.6475032584E-05        15     3
 intlbfgs> Mean deviation     0.1390821068     Decreasing QCI force constant to      1.917164747    
 intlbfgs> largest atomic distance between images is     0.8956804145     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.59953E-04 d,ref,cutoff=     1.4358         1.7205        0.28316     max grad=    0.48872E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219128253        0.1385325830    
 intlbfgs> Highest QCI image energy=    0.5995256796E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5995256796E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    225    0.5995256796E-04   -0.1000000000+201    0.4887229609E-01     0.000000000        0.1269080596E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8954967025     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.58512E-04 d,ref,cutoff=     1.4358         1.7205        0.28316     max grad=    0.48295E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219128802        0.1256326171    
 intlbfgs> Highest QCI image energy=    0.5851229167E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5851229167E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    226    0.5851229167E-04   -0.1000000000+201    0.4829538746E-01     0.000000000        0.2937436331E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956722492     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.59938E-04 d,ref,cutoff=     1.4358         1.7205        0.28316     max grad=    0.48867E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219128267        0.1379236351    
 intlbfgs> Highest QCI image energy=    0.5993777865E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5993777865E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    227    0.5993777865E-04   -0.1000000000+201    0.4886693580E-01     0.000000000        0.2810878551E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.8956728513     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.59888E-04 d,ref,cutoff=     1.4358         1.7205        0.28316     max grad=    0.48847E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219128277        0.1379549861    
 intlbfgs> Highest QCI image energy=    0.5988826211E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5988826211E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    228    0.5988826211E-04   -0.1000000000+201    0.4884656616E-01     0.000000000        0.1754958315E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956783348     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.59030E-04 d,ref,cutoff=     1.4358         1.7205        0.28316     max grad=    0.48493E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219128456        0.1381723608    
 intlbfgs> Highest QCI image energy=    0.5902975580E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5902975580E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    229    0.5902975580E-04   -0.1000000000+201    0.4849257179E-01     0.000000000        0.2428755505E-04        15     3
 intlbfgs> Mean deviation     0.1381723608     Decreasing QCI force constant to      1.898182918    
 intlbfgs> largest atomic distance between images is     0.8956780807     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.58940E-04 d,ref,cutoff=     1.4358         1.7205        0.28316     max grad=    0.48456E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219128474        0.1382073439    
 intlbfgs> Highest QCI image energy=    0.5894008382E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5894008382E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    230    0.5894008382E-04   -0.1000000000+201    0.4845563719E-01     0.000000000        0.6459890451E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956759963     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.58830E-04 d,ref,cutoff=     1.4358         1.7205        0.28316     max grad=    0.48412E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219128490        0.1388268450    
 intlbfgs> Highest QCI image energy=    0.5883032644E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5883032644E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    231    0.5883032644E-04   -0.1000000000+201    0.4841165121E-01     0.000000000        0.9328041707E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956835759     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.58999E-04 d,ref,cutoff=     1.4358         1.7205        0.28316     max grad=    0.48480E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219128452        0.1387472403    
 intlbfgs> Highest QCI image energy=    0.5899949317E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5899949317E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    232    0.5899949317E-04   -0.1000000000+201    0.4847991642E-01     0.000000000        0.7613627180E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.8956878965     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.58931E-04 d,ref,cutoff=     1.4358         1.7205        0.28316     max grad=    0.48451E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219128462        0.1390296094    
 intlbfgs> Highest QCI image energy=    0.5893146969E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5893146969E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    233    0.5893146969E-04   -0.1000000000+201    0.4845138331E-01     0.000000000        0.7519944515E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956963653     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.58631E-04 d,ref,cutoff=     1.4358         1.7205        0.28316     max grad=    0.48327E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219128516        0.1396553658    
 intlbfgs> Highest QCI image energy=    0.5863142973E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5863142973E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    234    0.5863142973E-04   -0.1000000000+201    0.4832650693E-01     0.000000000        0.1371924836E-04        15     3
 intlbfgs> Mean deviation     0.1396553658     Decreasing QCI force constant to      1.879389027    
 intlbfgs> largest atomic distance between images is     0.8956743802     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.57517E-04 d,ref,cutoff=     1.4358         1.7205        0.28316     max grad=    0.47865E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219128781        0.1381569756    
 intlbfgs> Highest QCI image energy=    0.5751709061E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5751709061E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    235    0.5751709061E-04   -0.1000000000+201    0.4786472729E-01     0.000000000        0.3812188330E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956535480     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.50431E-04 d,ref,cutoff=     1.4359         1.7205        0.28316     max grad=    0.44807E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219130387        0.1370637114    
 intlbfgs> Highest QCI image energy=    0.5043142723E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5043142723E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    236    0.5043142723E-04   -0.1000000000+201    0.4480703813E-01     0.000000000        0.8958621146E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956790752     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.56640E-04 d,ref,cutoff=     1.4358         1.7205        0.28316     max grad=    0.47496E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219128966        0.1385090354    
 intlbfgs> Highest QCI image energy=    0.5664002799E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5664002799E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    237    0.5664002799E-04   -0.1000000000+201    0.4749610567E-01     0.000000000        0.8615043207E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956812442     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.56635E-04 d,ref,cutoff=     1.4358         1.7205        0.28316     max grad=    0.47494E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219128964        0.1386573453    
 intlbfgs> Highest QCI image energy=    0.5663489368E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5663489368E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    238    0.5663489368E-04   -0.1000000000+201    0.4749374014E-01     0.000000000        0.3524067984E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956821076     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.56593E-04 d,ref,cutoff=     1.4358         1.7205        0.28316     max grad=    0.47476E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219128974        0.1386140920    
 intlbfgs> Highest QCI image energy=    0.5659270199E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5659270199E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    239    0.5659270199E-04   -0.1000000000+201    0.4747571876E-01     0.000000000        0.1286637417E-04        15     3
 intlbfgs> Mean deviation     0.1386140920     Decreasing QCI force constant to      1.860781215    
 intlbfgs> largest atomic distance between images is     0.8956822851     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.56600E-04 d,ref,cutoff=     1.4358         1.7205        0.28316     max grad=    0.47479E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219128972        0.1386371448    
 intlbfgs> Highest QCI image energy=    0.5660024042E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5660024042E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    240    0.5660024042E-04   -0.1000000000+201    0.4747889682E-01     0.000000000        0.1317112815E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956840963     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.56586E-04 d,ref,cutoff=     1.4358         1.7205        0.28316     max grad=    0.47473E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219128971        0.1388734164    
 intlbfgs> Highest QCI image energy=    0.5658608461E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5658608461E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    241    0.5658608461E-04   -0.1000000000+201    0.4747292859E-01     0.000000000        0.1346023253E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956896959     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.56359E-04 d,ref,cutoff=     1.4358         1.7205        0.28316     max grad=    0.47376E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219129016        0.1391641974    
 intlbfgs> Highest QCI image energy=    0.5635902728E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5635902728E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    242    0.5635902728E-04   -0.1000000000+201    0.4737644455E-01     0.000000000        0.1606665622E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956963871     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.56023E-04 d,ref,cutoff=     1.4358         1.7205        0.28316     max grad=    0.47234E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219129082        0.1395833862    
 intlbfgs> Highest QCI image energy=    0.5602340478E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5602340478E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    243    0.5602340478E-04   -0.1000000000+201    0.4723377434E-01     0.000000000        0.1290092195E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956983546     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.55871E-04 d,ref,cutoff=     1.4358         1.7205        0.28316     max grad=    0.47169E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219129113        0.1397350482    
 intlbfgs> Highest QCI image energy=    0.5587094501E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5587094501E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    244    0.5587094501E-04   -0.1000000000+201    0.4716897708E-01     0.000000000        0.3500827193E-05        15     3
 intlbfgs> Mean deviation     0.1397350482     Decreasing QCI force constant to      1.842357639    
 intlbfgs> largest atomic distance between images is     0.8956918838     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.55653E-04 d,ref,cutoff=     1.4358         1.7205        0.28316     max grad=    0.47077E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219129167        0.1393684613    
 intlbfgs> Highest QCI image energy=    0.5565266799E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5565266799E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    245    0.5565266799E-04   -0.1000000000+201    0.4707697872E-01     0.000000000        0.1557059352E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8955864546     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.54396E-04 d,ref,cutoff=     1.4359         1.7205        0.28316     max grad=    0.46551E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219129569        0.1330873784    
 intlbfgs> Highest QCI image energy=    0.5439645704E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5439645704E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    246    0.5439645704E-04   -0.1000000000+201    0.4655079982E-01     0.000000000        0.2245600347E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956764126     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.55622E-04 d,ref,cutoff=     1.4358         1.7205        0.28316     max grad=    0.47065E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219129192        0.1383363853    
 intlbfgs> Highest QCI image energy=    0.5562166844E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5562166844E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    247    0.5562166844E-04   -0.1000000000+201    0.4706524482E-01     0.000000000        0.2010492898E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.8956788854     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.55491E-04 d,ref,cutoff=     1.4359         1.7205        0.28316     max grad=    0.47010E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219129218        0.1385043018    
 intlbfgs> Highest QCI image energy=    0.5549126947E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5549126947E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    248    0.5549126947E-04   -0.1000000000+201    0.4700953291E-01     0.000000000        0.4114805751E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956900871     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.54558E-04 d,ref,cutoff=     1.4359         1.7205        0.28316     max grad=    0.46610E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219129411        0.1392945538    
 intlbfgs> Highest QCI image energy=    0.5455841048E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5455841048E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    249    0.5455841048E-04   -0.1000000000+201    0.4660972973E-01     0.000000000        0.1904590150E-04        15     3
 intlbfgs> Mean deviation     0.1392945538     Decreasing QCI force constant to      1.824116474    
 intlbfgs> largest atomic distance between images is     0.8956890780     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.54533E-04 d,ref,cutoff=     1.4359         1.7205        0.28316     max grad=    0.46599E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219129418        0.1392200409    
 intlbfgs> Highest QCI image energy=    0.5453307753E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5453307753E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    250    0.5453307753E-04   -0.1000000000+201    0.4659893595E-01     0.000000000        0.1666407243E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956723749     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.54549E-04 d,ref,cutoff=     1.4359         1.7205        0.28316     max grad=    0.46607E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219129435        0.1379712869    
 intlbfgs> Highest QCI image energy=    0.5454916278E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5454916278E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    251    0.5454916278E-04   -0.1000000000+201    0.4660720180E-01     0.000000000        0.2728775640E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956857594     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.54566E-04 d,ref,cutoff=     1.4359         1.7205        0.28316     max grad=    0.46613E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219129417        0.1388461179    
 intlbfgs> Highest QCI image energy=    0.5456578754E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5456578754E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    252    0.5456578754E-04   -0.1000000000+201    0.4661306966E-01     0.000000000        0.2313718831E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956829862     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.54569E-04 d,ref,cutoff=     1.4359         1.7205        0.28316     max grad=    0.46615E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219129418        0.1387273421    
 intlbfgs> Highest QCI image energy=    0.5456917041E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5456917041E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    253    0.5456917041E-04   -0.1000000000+201    0.4661487493E-01     0.000000000        0.1061534992E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956871142     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.54364E-04 d,ref,cutoff=     1.4359         1.7205        0.28316     max grad=    0.46526E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219129459        0.1390056929    
 intlbfgs> Highest QCI image energy=    0.5436419196E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5436419196E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    254    0.5436419196E-04   -0.1000000000+201    0.4652642239E-01     0.000000000        0.6873209467E-05        15     3
 intlbfgs> Mean deviation     0.1390056929     Decreasing QCI force constant to      1.806055915    
 intlbfgs> largest atomic distance between images is     0.8956856876     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.53460E-04 d,ref,cutoff=     1.4359         1.7205        0.28316     max grad=    0.46136E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219129662        0.1389278360    
 intlbfgs> Highest QCI image energy=    0.5346048152E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5346048152E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    255    0.5346048152E-04   -0.1000000000+201    0.4613630228E-01     0.000000000        0.9509471904E-05        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.8956571843     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.45200E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.42408E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219131633        0.1371013132    
 intlbfgs> Highest QCI image energy=    0.4519998626E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4519998626E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    256    0.4519998626E-04   -0.1000000000+201    0.4240782057E-01     0.000000000        0.1005192615E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956846704     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.52437E-04 d,ref,cutoff=     1.4359         1.7205        0.28316     max grad=    0.45690E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219129895        0.1388317894    
 intlbfgs> Highest QCI image energy=    0.5243651607E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5243651607E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    257    0.5243651607E-04   -0.1000000000+201    0.4569017564E-01     0.000000000        0.9182184410E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956847631     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.52437E-04 d,ref,cutoff=     1.4359         1.7205        0.28316     max grad=    0.45690E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219129895        0.1388378618    
 intlbfgs> Highest QCI image energy=    0.5243668590E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5243668590E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    258    0.5243668590E-04   -0.1000000000+201    0.4569024105E-01     0.000000000        0.1673322155E-06        15     3
 intlbfgs> largest atomic distance between images is     0.8956847015     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.52436E-04 d,ref,cutoff=     1.4359         1.7205        0.28316     max grad=    0.45690E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219129895        0.1388320162    
 intlbfgs> Highest QCI image energy=    0.5243616757E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5243616757E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    259    0.5243616757E-04   -0.1000000000+201    0.4569000751E-01     0.000000000        0.5106843133E-06        15     3
 intlbfgs> Mean deviation     0.1388320162     Decreasing QCI force constant to      1.788174173    
 intlbfgs> largest atomic distance between images is     0.8956846857     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.52436E-04 d,ref,cutoff=     1.4359         1.7205        0.28316     max grad=    0.45690E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219129895        0.1388308399    
 intlbfgs> Highest QCI image energy=    0.5243619034E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5243619034E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    260    0.5243619034E-04   -0.1000000000+201    0.4569001793E-01     0.000000000        0.3909059978E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8956695929     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.52436E-04 d,ref,cutoff=     1.4359         1.7205        0.28316     max grad=    0.45690E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219129915        0.1377031869    
 intlbfgs> Highest QCI image energy=    0.5243557695E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5243557695E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    261    0.5243557695E-04   -0.1000000000+201    0.4569018404E-01     0.000000000        0.3748169313E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956846335     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.52436E-04 d,ref,cutoff=     1.4359         1.7205        0.28316     max grad=    0.45690E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219129896        0.1388272920    
 intlbfgs> Highest QCI image energy=    0.5243613568E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5243613568E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    262    0.5243613568E-04   -0.1000000000+201    0.4568999799E-01     0.000000000        0.3744043350E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956846729     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.52436E-04 d,ref,cutoff=     1.4359         1.7205        0.28316     max grad=    0.45690E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219129896        0.1388299008    
 intlbfgs> Highest QCI image energy=    0.5243608139E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5243608139E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    263    0.5243608139E-04   -0.1000000000+201    0.4568997053E-01     0.000000000        0.6812216671E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8956859851     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.52432E-04 d,ref,cutoff=     1.4359         1.7205        0.28316     max grad=    0.45688E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219129895        0.1389167947    
 intlbfgs> Highest QCI image energy=    0.5243242927E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5243242927E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    264    0.5243242927E-04   -0.1000000000+201    0.4568824896E-01     0.000000000        0.2261522585E-05        15     3
 intlbfgs> Mean deviation     0.1389167947     Decreasing QCI force constant to      1.770469478    
 intlbfgs> largest atomic distance between images is     0.8956368115     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.30816E-04 d,ref,cutoff=     1.4362         1.7205        0.28316     max grad=    0.34989E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219135535        0.1358732089    
 intlbfgs> Highest QCI image energy=    0.3081565506E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3081565506E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    265    0.3081565506E-04   -0.1000000000+201    0.3498908868E-01     0.000000000        0.2625516876E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956852927     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.51400E-04 d,ref,cutoff=     1.4359         1.7205        0.28316     max grad=    0.45234E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219130131        0.1388799615    
 intlbfgs> Highest QCI image energy=    0.5139954582E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5139954582E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    266    0.5139954582E-04   -0.1000000000+201    0.4523384879E-01     0.000000000        0.2524435699E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956858656     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.50467E-04 d,ref,cutoff=     1.4359         1.7205        0.28316     max grad=    0.44820E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219130346        0.1389260971    
 intlbfgs> Highest QCI image energy=    0.5046687474E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5046687474E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    267    0.5046687474E-04   -0.1000000000+201    0.4481952356E-01     0.000000000        0.9205166681E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956858730     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.50468E-04 d,ref,cutoff=     1.4359         1.7205        0.28316     max grad=    0.44820E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219130345        0.1389265662    
 intlbfgs> Highest QCI image energy=    0.5046828395E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5046828395E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    268    0.5046828395E-04   -0.1000000000+201    0.4482015163E-01     0.000000000        0.2093476090E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8956858725     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.50468E-04 d,ref,cutoff=     1.4359         1.7205        0.28316     max grad=    0.44820E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219130345        0.1389265275    
 intlbfgs> Highest QCI image energy=    0.5046830537E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5046830537E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    269    0.5046830537E-04   -0.1000000000+201    0.4482016119E-01     0.000000000        0.1973369795E-08        15     3
 intlbfgs> Mean deviation     0.1389265275     Decreasing QCI force constant to      1.752940078    
 intlbfgs> largest atomic distance between images is     0.8956858583     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.50468E-04 d,ref,cutoff=     1.4359         1.7205        0.28316     max grad=    0.44820E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219130345        0.1389253855    
 intlbfgs> Highest QCI image energy=    0.5046838572E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5046838572E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    270    0.5046838572E-04   -0.1000000000+201    0.4482019730E-01     0.000000000        0.4652160741E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8956845667     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.50468E-04 d,ref,cutoff=     1.4359         1.7205        0.28316     max grad=    0.44820E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219130347        0.1388225148    
 intlbfgs> Highest QCI image energy=    0.5046823789E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5046823789E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    271    0.5046823789E-04   -0.1000000000+201    0.4482015790E-01     0.000000000        0.4083236730E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956856194     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.50468E-04 d,ref,cutoff=     1.4359         1.7205        0.28316     max grad=    0.44820E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219130346        0.1389089520    
 intlbfgs> Highest QCI image energy=    0.5046816134E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5046816134E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    272    0.5046816134E-04   -0.1000000000+201    0.4482011574E-01     0.000000000        0.3988746723E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956843361     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.50466E-04 d,ref,cutoff=     1.4359         1.7205        0.28316     max grad=    0.44819E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219130347        0.1388228780    
 intlbfgs> Highest QCI image energy=    0.5046609043E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5046609043E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    273    0.5046609043E-04   -0.1000000000+201    0.4481930315E-01     0.000000000        0.2056245215E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956840446     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.50463E-04 d,ref,cutoff=     1.4359         1.7205        0.28316     max grad=    0.44818E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219130349        0.1388038983    
 intlbfgs> Highest QCI image energy=    0.5046275408E-04 images=       1
 intlbfgs> Highest image        2 energy     0.5046275408E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    274    0.5046275408E-04   -0.1000000000+201    0.4481784229E-01     0.000000000        0.5420184997E-06        15     3
 intlbfgs> Mean deviation     0.1388038983     Decreasing QCI force constant to      1.735584235    
 intlbfgs> largest atomic distance between images is     0.8957446304     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.44405E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.42024E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219131733        0.1428363587    
 intlbfgs> Highest QCI image energy=    0.4440451920E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4440451920E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    275    0.4440451920E-04   -0.1000000000+201    0.4202363244E-01     0.000000000        0.1189901715E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956867146     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.49343E-04 d,ref,cutoff=     1.4359         1.7205        0.28316     max grad=    0.44315E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219130606        0.1389921398    
 intlbfgs> Highest QCI image energy=    0.4934288883E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4934288883E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    276    0.4934288883E-04   -0.1000000000+201    0.4431512343E-01     0.000000000        0.1107321656E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956872024     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.48573E-04 d,ref,cutoff=     1.4359         1.7205        0.28316     max grad=    0.43966E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219130787        0.1390335001    
 intlbfgs> Highest QCI image energy=    0.4857295293E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4857295293E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    277    0.4857295293E-04   -0.1000000000+201    0.4396633655E-01     0.000000000        0.7766413745E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956871770     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.48573E-04 d,ref,cutoff=     1.4359         1.7205        0.28316     max grad=    0.43966E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219130787        0.1390317540    
 intlbfgs> Highest QCI image energy=    0.4857288932E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4857288932E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    278    0.4857288932E-04   -0.1000000000+201    0.4396630966E-01     0.000000000        0.3810555639E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8956870031     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.48573E-04 d,ref,cutoff=     1.4359         1.7205        0.28316     max grad=    0.43966E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219130787        0.1390177901    
 intlbfgs> Highest QCI image energy=    0.4857251024E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4857251024E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    279    0.4857251024E-04   -0.1000000000+201    0.4396614353E-01     0.000000000        0.3800910934E-06        15     3
 intlbfgs> Mean deviation     0.1390177901     Decreasing QCI force constant to      1.718400233    
 intlbfgs> largest atomic distance between images is     0.8956869983     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.48573E-04 d,ref,cutoff=     1.4359         1.7205        0.28316     max grad=    0.43966E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219130787        0.1390174136    
 intlbfgs> Highest QCI image energy=    0.4857282963E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4857282963E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    280    0.4857282963E-04   -0.1000000000+201    0.4396628886E-01     0.000000000        0.1316733377E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8956869967     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.48573E-04 d,ref,cutoff=     1.4359         1.7205        0.28316     max grad=    0.43966E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219130787        0.1390172618    
 intlbfgs> Highest QCI image energy=    0.4857251033E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4857251033E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    281    0.4857251033E-04   -0.1000000000+201    0.4396614367E-01     0.000000000        0.7218189549E-08        15     3
 intlbfgs> largest atomic distance between images is     0.8956900349     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.47644E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.43542E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219131004        0.1392175030    
 intlbfgs> Highest QCI image energy=    0.4764368017E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4764368017E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    282    0.4764368017E-04   -0.1000000000+201    0.4354166499E-01     0.000000000        0.1343195770E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956872165     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.47668E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.43553E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219131002        0.1389954709    
 intlbfgs> Highest QCI image energy=    0.4766796316E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4766796316E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    283    0.4766796316E-04   -0.1000000000+201    0.4355288826E-01     0.000000000        0.6727018772E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956877289     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.47624E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.43533E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219131012        0.1390540305    
 intlbfgs> Highest QCI image energy=    0.4762412118E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4762412118E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    284    0.4762412118E-04   -0.1000000000+201    0.4353270768E-01     0.000000000        0.4089603678E-05        15     3
 intlbfgs> Mean deviation     0.1390540305     Decreasing QCI force constant to      1.701386369    
 intlbfgs> largest atomic distance between images is     0.8956879872     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.47646E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.43543E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219131006        0.1390896528    
 intlbfgs> Highest QCI image energy=    0.4764641813E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4764641813E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    285    0.4764641813E-04   -0.1000000000+201    0.4354292236E-01     0.000000000        0.2944533320E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956892485     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.47613E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.43528E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219131011        0.1392472520    
 intlbfgs> Highest QCI image energy=    0.4761342825E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4761342825E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    286    0.4761342825E-04   -0.1000000000+201    0.4352765887E-01     0.000000000        0.1171159756E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956983377     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.47375E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.43418E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219131058        0.1398736826    
 intlbfgs> Highest QCI image energy=    0.4737500138E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4737500138E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    287    0.4737500138E-04   -0.1000000000+201    0.4341757795E-01     0.000000000        0.1655346652E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8957033191     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.47172E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.43324E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219131100        0.1402225380    
 intlbfgs> Highest QCI image energy=    0.4717189322E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4717189322E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    288    0.4717189322E-04   -0.1000000000+201    0.4332370549E-01     0.000000000        0.8307735936E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8957041719     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.47023E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.43255E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219131135        0.1402737104    
 intlbfgs> Highest QCI image energy=    0.4702277443E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4702277443E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    289    0.4702277443E-04   -0.1000000000+201    0.4325478764E-01     0.000000000        0.2356809470E-05        15     3
 intlbfgs> Mean deviation     0.1402737104     Decreasing QCI force constant to      1.684540960    
 intlbfgs> largest atomic distance between images is     0.8956949870     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.46765E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.43136E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219131209        0.1395999127    
 intlbfgs> Highest QCI image energy=    0.4676504295E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4676504295E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    290    0.4676504295E-04   -0.1000000000+201    0.4313595975E-01     0.000000000        0.1596719977E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956349348     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.46463E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.42999E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219131357        0.1352748824    
 intlbfgs> Highest QCI image energy=    0.4646288148E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4646288148E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    291    0.4646288148E-04   -0.1000000000+201    0.4299868400E-01     0.000000000        0.9916613329E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956851874     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.46386E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.42960E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219131311        0.1389760554    
 intlbfgs> Highest QCI image energy=    0.4638558900E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4638558900E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    292    0.4638558900E-04   -0.1000000000+201    0.4296041033E-01     0.000000000        0.8585332218E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956914107     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.46356E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.42946E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219131313        0.1392675085    
 intlbfgs> Highest QCI image energy=    0.4635616783E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4635616783E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    293    0.4635616783E-04   -0.1000000000+201    0.4294623549E-01     0.000000000        0.2350704010E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956762471     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.43638E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.41663E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219131999        0.1382515396    
 intlbfgs> Highest QCI image energy=    0.4363785616E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4363785616E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    294    0.4363785616E-04   -0.1000000000+201    0.4166282422E-01     0.000000000        0.4485383562E-04        15     3
 intlbfgs> Mean deviation     0.1382515396     Decreasing QCI force constant to      1.667862336    
 intlbfgs> largest atomic distance between images is     0.8956897033     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.45863E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.42716E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219131434        0.1392225866    
 intlbfgs> Highest QCI image energy=    0.4586292401E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4586292401E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    295    0.4586292401E-04   -0.1000000000+201    0.4271621563E-01     0.000000000        0.3784409982E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956906782     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.45236E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.42422E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219131585        0.1392941700    
 intlbfgs> Highest QCI image energy=    0.4523615493E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4523615493E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    296    0.4523615493E-04   -0.1000000000+201    0.4242188526E-01     0.000000000        0.6722896410E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956910231     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.44993E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.42307E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219131645        0.1393200598    
 intlbfgs> Highest QCI image energy=    0.4499250049E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4499250049E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    297    0.4499250049E-04   -0.1000000000+201    0.4230692679E-01     0.000000000        0.2592048405E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956910025     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.44991E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.42306E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219131645        0.1393186875    
 intlbfgs> Highest QCI image energy=    0.4499137158E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4499137158E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    298    0.4499137158E-04   -0.1000000000+201    0.4230639831E-01     0.000000000        0.1822305914E-06        15     3
 intlbfgs> largest atomic distance between images is     0.8956899963     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.44986E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.42304E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219131648        0.1392495806    
 intlbfgs> Highest QCI image energy=    0.4498627876E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4498627876E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    299    0.4498627876E-04   -0.1000000000+201    0.4230413937E-01     0.000000000        0.4498009229E-05        15     3
 intlbfgs> Mean deviation     0.1392495806     Decreasing QCI force constant to      1.651348848    
 intlbfgs> largest atomic distance between images is     0.8956893112     for atom     10 and images      2     3 total images=     1
 checkrep> number of active repulsions and total=      58      58
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.44989E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.42306E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219131648        0.1392028963    
 intlbfgs> Highest QCI image energy=    0.4498906769E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4498906769E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    300    0.4498906769E-04   -0.1000000000+201    0.4230550224E-01     0.000000000        0.9855902035E-06        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.8956703317     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.44977E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.42301E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219131673        0.1379103656    
 intlbfgs> Highest QCI image energy=    0.4497748414E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4497748414E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    301    0.4497748414E-04   -0.1000000000+201    0.4230129586E-01     0.000000000        0.2735497737E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956881518     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.44963E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.42293E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219131655        0.1391281904    
 intlbfgs> Highest QCI image energy=    0.4496254408E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4496254408E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    302    0.4496254408E-04   -0.1000000000+201    0.4229314827E-01     0.000000000        0.2647427035E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956896996     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.44940E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.42282E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219131659        0.1392302719    
 intlbfgs> Highest QCI image energy=    0.4494012248E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4494012248E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    303    0.4494012248E-04   -0.1000000000+201    0.4228242079E-01     0.000000000        0.2629387774E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956971922     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.44677E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.42157E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219131716        0.1397038013    
 intlbfgs> Highest QCI image energy=    0.4467650623E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4467650623E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    304    0.4467650623E-04   -0.1000000000+201    0.4215680904E-01     0.000000000        0.2017679846E-04        15     3
 intlbfgs> Mean deviation     0.1397038013     Decreasing QCI force constant to      1.634998859    
 intlbfgs> largest atomic distance between images is     0.8956721283     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.43721E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.41704E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219131981        0.1380579524    
 intlbfgs> Highest QCI image energy=    0.4372101358E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4372101358E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    305    0.4372101358E-04   -0.1000000000+201    0.4170358910E-01     0.000000000        0.4372277594E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956739907     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.42587E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.41157E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219132264        0.1381961279    
 intlbfgs> Highest QCI image energy=    0.4258700901E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4258700901E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    306    0.4258700901E-04   -0.1000000000+201    0.4115661885E-01     0.000000000        0.1230188286E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956865866     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.43295E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.41498E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219132072        0.1390205712    
 intlbfgs> Highest QCI image energy=    0.4329458174E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4329458174E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    307    0.4329458174E-04   -0.1000000000+201    0.4149761603E-01     0.000000000        0.2285538100E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956884366     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.43300E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.41500E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219132068        0.1391463146    
 intlbfgs> Highest QCI image energy=    0.4329966733E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4329966733E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    308    0.4329966733E-04   -0.1000000000+201    0.4149994217E-01     0.000000000        0.2673228295E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956902924     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.43298E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.41499E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219132066        0.1392809843    
 intlbfgs> Highest QCI image energy=    0.4329826129E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4329826129E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    309    0.4329826129E-04   -0.1000000000+201    0.4149920403E-01     0.000000000        0.4004733403E-05        15     3
 intlbfgs> Mean deviation     0.1392809843     Decreasing QCI force constant to      1.618810752    
 intlbfgs> largest atomic distance between images is     0.8956903154     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.43296E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.41498E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219132067        0.1392848876    
 intlbfgs> Highest QCI image energy=    0.4329569997E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4329569997E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    310    0.4329569997E-04   -0.1000000000+201    0.4149798587E-01     0.000000000        0.8109894606E-06        15     3
 intlbfgs> largest atomic distance between images is     0.8956912629     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.43294E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.41497E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219132066        0.1393988206    
 intlbfgs> Highest QCI image energy=    0.4329374441E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4329374441E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    311    0.4329374441E-04   -0.1000000000+201    0.4149733039E-01     0.000000000        0.1728108840E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956735667     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.43226E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.41466E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219132104        0.1381465279    
 intlbfgs> Highest QCI image energy=    0.4322604728E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4322604728E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    312    0.4322604728E-04   -0.1000000000+201    0.4146558186E-01     0.000000000        0.2957791069E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956858753     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.43252E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.41477E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219132083        0.1389738853    
 intlbfgs> Highest QCI image energy=    0.4325234301E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4325234301E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    313    0.4325234301E-04   -0.1000000000+201    0.4147734703E-01     0.000000000        0.1833700485E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956873163     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.43234E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.41468E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219132086        0.1390797120    
 intlbfgs> Highest QCI image energy=    0.4323365190E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4323365190E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    314    0.4323365190E-04   -0.1000000000+201    0.4146829943E-01     0.000000000        0.3243968483E-05        15     3
 intlbfgs> Mean deviation     0.1390797120     Decreasing QCI force constant to      1.602782922    
 intlbfgs> largest atomic distance between images is     0.8956663719     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.39390E-04 d,ref,cutoff=     1.4361         1.7205        0.28316     max grad=    0.39574E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219133103        0.1375107018    
 intlbfgs> Highest QCI image energy=    0.3938966996E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3938966996E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    315    0.3938966996E-04   -0.1000000000+201    0.3957392847E-01     0.000000000        0.7982438035E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956908445     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.42276E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.41004E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219132324        0.1393277449    
 intlbfgs> Highest QCI image energy=    0.4227581802E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4227581802E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    316    0.4227581802E-04   -0.1000000000+201    0.4100406705E-01     0.000000000        0.7664402893E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956916103     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.41665E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.40705E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219132478        0.1393856423    
 intlbfgs> Highest QCI image energy=    0.4166476537E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4166476537E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    317    0.4166476537E-04   -0.1000000000+201    0.4070528860E-01     0.000000000        0.6669671519E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956915751     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.41665E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.40705E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219132478        0.1393831183    
 intlbfgs> Highest QCI image energy=    0.4166504289E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4166504289E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    318    0.4166504289E-04   -0.1000000000+201    0.4070542618E-01     0.000000000        0.6639205001E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8956914804     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.41665E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.40706E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219132478        0.1393769523    
 intlbfgs> Highest QCI image energy=    0.4166534407E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4166534407E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    319    0.4166534407E-04   -0.1000000000+201    0.4070558136E-01     0.000000000        0.1493459192E-06        15     3
 intlbfgs> Mean deviation     0.1393769523     Decreasing QCI force constant to      1.586913785    
 intlbfgs> largest atomic distance between images is     0.8956913791     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.41665E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.40705E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219132478        0.1393706458    
 intlbfgs> Highest QCI image energy=    0.4166505997E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4166505997E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    320    0.4166505997E-04   -0.1000000000+201    0.4070545150E-01     0.000000000        0.2091736617E-06        15     3
 intlbfgs> largest atomic distance between images is     0.8956772447     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.41663E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.40706E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219132494        0.1384911768    
 intlbfgs> Highest QCI image energy=    0.4166338568E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4166338568E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    321    0.4166338568E-04   -0.1000000000+201    0.4070596070E-01     0.000000000        0.2916465235E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956926688     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.41664E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.40705E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219132477        0.1394645459    
 intlbfgs> Highest QCI image energy=    0.4166399321E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4166399321E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    322    0.4166399321E-04   -0.1000000000+201    0.4070488415E-01     0.000000000        0.2910933416E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956914541     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.41663E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.40704E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219132479        0.1393766928    
 intlbfgs> Highest QCI image energy=    0.4166303458E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4166303458E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    323    0.4166303458E-04   -0.1000000000+201    0.4070445719E-01     0.000000000        0.2475615332E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956907519     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.41661E-04 d,ref,cutoff=     1.4360         1.7205        0.28316     max grad=    0.40703E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219132480        0.1393257385    
 intlbfgs> Highest QCI image energy=    0.4166097036E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4166097036E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    324    0.4166097036E-04   -0.1000000000+201    0.4070346863E-01     0.000000000        0.1465674674E-05        15     3
 intlbfgs> Mean deviation     0.1393257385     Decreasing QCI force constant to      1.571201767    
 intlbfgs> largest atomic distance between images is     0.8957617453     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.23283E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.30393E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219137802        0.1445754036    
 intlbfgs> Highest QCI image energy=    0.2328301068E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2328301068E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    325    0.2328301068E-04   -0.1000000000+201    0.3039261472E-01     0.000000000        0.2574977410E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956919343     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.40840E-04 d,ref,cutoff=     1.4361         1.7205        0.28316     max grad=    0.40299E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219132690        0.1394155145    
 intlbfgs> Highest QCI image energy=    0.4084032080E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4084032080E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    326    0.4084032080E-04   -0.1000000000+201    0.4029875242E-01     0.000000000        0.2489161065E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956924786     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.40094E-04 d,ref,cutoff=     1.4361         1.7205        0.28316     max grad=    0.39927E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219132883        0.1394585627    
 intlbfgs> Highest QCI image energy=    0.4009357548E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4009357548E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    327    0.4009357548E-04   -0.1000000000+201    0.3992698499E-01     0.000000000        0.8273364166E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956924707     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.40095E-04 d,ref,cutoff=     1.4361         1.7205        0.28316     max grad=    0.39928E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219132883        0.1394579928    
 intlbfgs> Highest QCI image energy=    0.4009467458E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4009467458E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    328    0.4009467458E-04   -0.1000000000+201    0.3992753500E-01     0.000000000        0.1732691096E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8956924688     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.40095E-04 d,ref,cutoff=     1.4361         1.7205        0.28316     max grad=    0.39928E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219132883        0.1394578602    
 intlbfgs> Highest QCI image energy=    0.4009471819E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4009471819E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    329    0.4009471819E-04   -0.1000000000+201    0.3992755695E-01     0.000000000        0.2992862483E-08        15     3
 intlbfgs> Mean deviation     0.1394578602     Decreasing QCI force constant to      1.555645314    
 intlbfgs> largest atomic distance between images is     0.8956924326     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.40095E-04 d,ref,cutoff=     1.4361         1.7205        0.28316     max grad=    0.39928E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219132883        0.1394554314    
 intlbfgs> Highest QCI image energy=    0.4009498299E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4009498299E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    330    0.4009498299E-04   -0.1000000000+201    0.3992769214E-01     0.000000000        0.5874465135E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8956921312     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.40095E-04 d,ref,cutoff=     1.4361         1.7205        0.28316     max grad=    0.39928E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219132883        0.1394352659    
 intlbfgs> Highest QCI image energy=    0.4009470935E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4009470935E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    331    0.4009470935E-04   -0.1000000000+201    0.3992757898E-01     0.000000000        0.5064891298E-06        15     3
 intlbfgs> largest atomic distance between images is     0.8956925207     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.40081E-04 d,ref,cutoff=     1.4361         1.7205        0.28316     max grad=    0.39921E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219132886        0.1394695650    
 intlbfgs> Highest QCI image energy=    0.4008129012E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4008129012E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    332    0.4008129012E-04   -0.1000000000+201    0.3992090066E-01     0.000000000        0.3180388579E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956959858     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.40014E-04 d,ref,cutoff=     1.4361         1.7205        0.28316     max grad=    0.39887E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219132899        0.1397286330    
 intlbfgs> Highest QCI image energy=    0.4001350096E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4001350096E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    333    0.4001350096E-04   -0.1000000000+201    0.3988691782E-01     0.000000000        0.9648184325E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956988101     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.39932E-04 d,ref,cutoff=     1.4361         1.7205        0.28316     max grad=    0.39846E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219132917        0.1399338332    
 intlbfgs> Highest QCI image energy=    0.3993189614E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3993189614E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    334    0.3993189614E-04   -0.1000000000+201    0.3984594849E-01     0.000000000        0.5798079944E-05        15     3
 intlbfgs> Mean deviation     0.1399338332     Decreasing QCI force constant to      1.540242885    
 intlbfgs> largest atomic distance between images is     0.8956891923     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.38995E-04 d,ref,cutoff=     1.4361         1.7205        0.28316     max grad=    0.39374E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219133177        0.1391863681    
 intlbfgs> Highest QCI image energy=    0.3899521166E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3899521166E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    335    0.3899521166E-04   -0.1000000000+201    0.3937370820E-01     0.000000000        0.4290554616E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956984237     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.37751E-04 d,ref,cutoff=     1.4361         1.7205        0.28316     max grad=    0.38737E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219133498        0.1398393302    
 intlbfgs> Highest QCI image energy=    0.3775095350E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3775095350E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    336    0.3775095350E-04   -0.1000000000+201    0.3873726861E-01     0.000000000        0.1865762308E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956988167     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.38596E-04 d,ref,cutoff=     1.4361         1.7205        0.28316     max grad=    0.39170E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219133271        0.1398942656    
 intlbfgs> Highest QCI image energy=    0.3859553256E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3859553256E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    337    0.3859553256E-04   -0.1000000000+201    0.3917027418E-01     0.000000000        0.1757791488E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956986830     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.38597E-04 d,ref,cutoff=     1.4361         1.7205        0.28316     max grad=    0.39171E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219133270        0.1398873091    
 intlbfgs> Highest QCI image energy=    0.3859737607E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3859737607E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    338    0.3859737607E-04   -0.1000000000+201    0.3917123916E-01     0.000000000        0.9884732005E-06        15     3
 intlbfgs> largest atomic distance between images is     0.8956942129     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.38585E-04 d,ref,cutoff=     1.4361         1.7205        0.28316     max grad=    0.39165E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219133278        0.1395904307    
 intlbfgs> Highest QCI image energy=    0.3858539369E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3858539369E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    339    0.3858539369E-04   -0.1000000000+201    0.3916548929E-01     0.000000000        0.7883420700E-05        15     3
 intlbfgs> Mean deviation     0.1395904307     Decreasing QCI force constant to      1.524992955    
 intlbfgs> largest atomic distance between images is     0.8956934067     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.38583E-04 d,ref,cutoff=     1.4361         1.7205        0.28316     max grad=    0.39164E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219133280        0.1395343821    
 intlbfgs> Highest QCI image energy=    0.3858289006E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3858289006E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    340    0.3858289006E-04   -0.1000000000+201    0.3916425770E-01     0.000000000        0.1167172449E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956497326     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.38563E-04 d,ref,cutoff=     1.4361         1.7205        0.28316     max grad=    0.39157E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219133338        0.1364992848    
 intlbfgs> Highest QCI image energy=    0.3856295068E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3856295068E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    341    0.3856295068E-04   -0.1000000000+201    0.3915652068E-01     0.000000000        0.6288815643E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956933035     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.38573E-04 d,ref,cutoff=     1.4361         1.7205        0.28316     max grad=    0.39159E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219133283        0.1395180322    
 intlbfgs> Highest QCI image energy=    0.3857279081E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3857279081E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    342    0.3857279081E-04   -0.1000000000+201    0.3915904788E-01     0.000000000        0.6203988575E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956932858     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.38565E-04 d,ref,cutoff=     1.4361         1.7205        0.28316     max grad=    0.39155E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219133285        0.1395222544    
 intlbfgs> Highest QCI image energy=    0.3856467754E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3856467754E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    343    0.3856467754E-04   -0.1000000000+201    0.3915495246E-01     0.000000000        0.2194515466E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956926820     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.38484E-04 d,ref,cutoff=     1.4361         1.7205        0.28316     max grad=    0.39114E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219133307        0.1395121240    
 intlbfgs> Highest QCI image energy=    0.3848381482E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3848381482E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    344    0.3848381482E-04   -0.1000000000+201    0.3911396581E-01     0.000000000        0.1242536947E-04        15     3
 intlbfgs> Mean deviation     0.1395121240     Decreasing QCI force constant to      1.509894015    
 intlbfgs> largest atomic distance between images is     0.8956979452     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.35552E-04 d,ref,cutoff=     1.4361         1.7205        0.28316     max grad=    0.37586E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219134103        0.1397006482    
 intlbfgs> Highest QCI image energy=    0.3555161862E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3555161862E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    345    0.3555161862E-04   -0.1000000000+201    0.3758641022E-01     0.000000000        0.8722809508E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956941174     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.37646E-04 d,ref,cutoff=     1.4361         1.7205        0.28316     max grad=    0.38684E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219133530        0.1395901422    
 intlbfgs> Highest QCI image energy=    0.3764637813E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3764637813E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    346    0.3764637813E-04   -0.1000000000+201    0.3868395763E-01     0.000000000        0.7322557129E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956942037     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.37126E-04 d,ref,cutoff=     1.4361         1.7205        0.28316     max grad=    0.38414E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219133671        0.1396022164    
 intlbfgs> Highest QCI image energy=    0.3712577201E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3712577201E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    347    0.3712577201E-04   -0.1000000000+201    0.3841443089E-01     0.000000000        0.6047977797E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956942159     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.37127E-04 d,ref,cutoff=     1.4361         1.7205        0.28316     max grad=    0.38415E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219133671        0.1396027704    
 intlbfgs> Highest QCI image energy=    0.3712650775E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3712650775E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    348    0.3712650775E-04   -0.1000000000+201    0.3841481053E-01     0.000000000        0.1056564988E-06        15     3
 intlbfgs> largest atomic distance between images is     0.8956942537     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.37127E-04 d,ref,cutoff=     1.4361         1.7205        0.28316     max grad=    0.38415E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219133670        0.1396052161    
 intlbfgs> Highest QCI image energy=    0.3712667254E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3712667254E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    349    0.3712667254E-04   -0.1000000000+201    0.3841489335E-01     0.000000000        0.6056507029E-07        15     3
 intlbfgs> Mean deviation     0.1396052161     Decreasing QCI force constant to      1.494944570    
 intlbfgs> largest atomic distance between images is     0.8956944549     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.37127E-04 d,ref,cutoff=     1.4361         1.7205        0.28316     max grad=    0.38415E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219133670        0.1396185890    
 intlbfgs> Highest QCI image energy=    0.3712672875E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3712672875E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    350    0.3712672875E-04   -0.1000000000+201    0.3841491030E-01     0.000000000        0.3015394052E-06        15     3
 intlbfgs> largest atomic distance between images is     0.8961604524     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.37044E-04 d,ref,cutoff=     1.4361         1.7205        0.28316     max grad=    0.38344E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219133301        0.1705994406    
 intlbfgs> Highest QCI image energy=    0.3704430275E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3704430275E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    351    0.3704430275E-04   -0.1000000000+201    0.3834372608E-01     0.000000000        0.6983440530E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956946490     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.37127E-04 d,ref,cutoff=     1.4361         1.7205        0.28316     max grad=    0.38415E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219133670        0.1396320574    
 intlbfgs> Highest QCI image energy=    0.3712661500E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3712661500E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    352    0.3712661500E-04   -0.1000000000+201    0.3841484357E-01     0.000000000        0.6980273429E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956946665     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.37127E-04 d,ref,cutoff=     1.4361         1.7205        0.28316     max grad=    0.38415E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219133670        0.1396326765    
 intlbfgs> Highest QCI image energy=    0.3712653249E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3712653249E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    353    0.3712653249E-04   -0.1000000000+201    0.3841479549E-01     0.000000000        0.2356968969E-06        15     3
 intlbfgs> largest atomic distance between images is     0.8956947532     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.37126E-04 d,ref,cutoff=     1.4361         1.7205        0.28316     max grad=    0.38414E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219133670        0.1396356994    
 intlbfgs> Highest QCI image energy=    0.3712562379E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3712562379E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    354    0.3712562379E-04   -0.1000000000+201    0.3841429735E-01     0.000000000        0.1177601420E-05        15     3
 intlbfgs> Mean deviation     0.1396356994     Decreasing QCI force constant to      1.480143138    
 intlbfgs> largest atomic distance between images is     0.8956960900     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.17646E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.26450E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219139962        0.1401456878    
 intlbfgs> Highest QCI image energy=    0.1764609338E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1764609338E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    355    0.1764609338E-04   -0.1000000000+201    0.2645028109E-01     0.000000000        0.2801324895E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956949750     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.36395E-04 d,ref,cutoff=     1.4361         1.7205        0.28316     max grad=    0.38033E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219133869        0.1396604451    
 intlbfgs> Highest QCI image energy=    0.3639508539E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3639508539E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    356    0.3639508539E-04   -0.1000000000+201    0.3803290340E-01     0.000000000        0.2716704129E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956952010     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.35723E-04 d,ref,cutoff=     1.4361         1.7205        0.28316     max grad=    0.37679E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219134054        0.1396821560    
 intlbfgs> Highest QCI image energy=    0.3572329126E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3572329126E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    357    0.3572329126E-04   -0.1000000000+201    0.3767879285E-01     0.000000000        0.7895192110E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956952077     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.35724E-04 d,ref,cutoff=     1.4361         1.7205        0.28316     max grad=    0.37679E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219134054        0.1396825883    
 intlbfgs> Highest QCI image energy=    0.3572448645E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3572448645E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    358    0.3572448645E-04   -0.1000000000+201    0.3767942529E-01     0.000000000        0.1812387870E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8956952216     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.35725E-04 d,ref,cutoff=     1.4361         1.7205        0.28316     max grad=    0.37680E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219134054        0.1396834995    
 intlbfgs> Highest QCI image energy=    0.3572507727E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3572507727E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    359    0.3572507727E-04   -0.1000000000+201    0.3767973727E-01     0.000000000        0.2231635306E-07        15     3
 intlbfgs> Mean deviation     0.1396834995     Decreasing QCI force constant to      1.465488256    
 intlbfgs> largest atomic distance between images is     0.8956952852     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.35726E-04 d,ref,cutoff=     1.4361         1.7205        0.28316     max grad=    0.37680E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219134053        0.1396877017    
 intlbfgs> Highest QCI image energy=    0.3572619064E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3572619064E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    360    0.3572619064E-04   -0.1000000000+201    0.3768032285E-01     0.000000000        0.9641674173E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8956953707     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.35725E-04 d,ref,cutoff=     1.4361         1.7205        0.28316     max grad=    0.37680E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219134053        0.1396933790    
 intlbfgs> Highest QCI image energy=    0.3572507941E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3572507941E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    361    0.3572507941E-04   -0.1000000000+201    0.3767972915E-01     0.000000000        0.1262545307E-06        15     3
 intlbfgs> largest atomic distance between images is     0.8957067720     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.35407E-04 d,ref,cutoff=     1.4361         1.7205        0.28316     max grad=    0.37510E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219134129        0.1404534565    
 intlbfgs> Highest QCI image energy=    0.3540700357E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3540700357E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    362    0.3540700357E-04   -0.1000000000+201    0.3751023128E-01     0.000000000        0.1699953411E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8957051413     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.35184E-04 d,ref,cutoff=     1.4362         1.7205        0.28316     max grad=    0.37391E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219134193        0.1403489878    
 intlbfgs> Highest QCI image energy=    0.3518357686E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3518357686E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    363    0.3518357686E-04   -0.1000000000+201    0.3739132109E-01     0.000000000        0.3788556342E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956978698     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.35037E-04 d,ref,cutoff=     1.4362         1.7205        0.28316     max grad=    0.37314E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219134242        0.1398696347    
 intlbfgs> Highest QCI image energy=    0.3503714423E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3503714423E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    364    0.3503714423E-04   -0.1000000000+201    0.3731356681E-01     0.000000000        0.1108388849E-04        15     3
 intlbfgs> Mean deviation     0.1398696347     Decreasing QCI force constant to      1.450978471    
 intlbfgs> largest atomic distance between images is     0.8956957904     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.35047E-04 d,ref,cutoff=     1.4362         1.7205        0.28316     max grad=    0.37319E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219134242        0.1397314036    
 intlbfgs> Highest QCI image energy=    0.3504691375E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3504691375E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    365    0.3504691375E-04   -0.1000000000+201    0.3731891530E-01     0.000000000        0.3078695900E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956757158     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.35011E-04 d,ref,cutoff=     1.4362         1.7205        0.28316     max grad=    0.37301E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219134275        0.1383992902    
 intlbfgs> Highest QCI image energy=    0.3501103874E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3501103874E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    366    0.3501103874E-04   -0.1000000000+201    0.3730095133E-01     0.000000000        0.2982642745E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956931864     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.35023E-04 d,ref,cutoff=     1.4362         1.7205        0.28316     max grad=    0.37306E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219134251        0.1395573395    
 intlbfgs> Highest QCI image energy=    0.3502287642E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3502287642E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    367    0.3502287642E-04   -0.1000000000+201    0.3730621099E-01     0.000000000        0.2591993789E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956949914     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.34980E-04 d,ref,cutoff=     1.4362         1.7205        0.28316     max grad=    0.37283E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219134261        0.1396840730    
 intlbfgs> Highest QCI image energy=    0.3498038911E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3498038911E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    368    0.3498038911E-04   -0.1000000000+201    0.3728341914E-01     0.000000000        0.3814862082E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956982152     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.34665E-04 d,ref,cutoff=     1.4362         1.7205        0.28316     max grad=    0.37114E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219134345        0.1399448949    
 intlbfgs> Highest QCI image energy=    0.3466516628E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3466516628E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    369    0.3466516628E-04   -0.1000000000+201    0.3711447735E-01     0.000000000        0.1875376599E-04        15     3
 intlbfgs> Mean deviation     0.1399448949     Decreasing QCI force constant to      1.436612347    
 intlbfgs> largest atomic distance between images is     0.8956890639     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.34421E-04 d,ref,cutoff=     1.4362         1.7205        0.28316     max grad=    0.36983E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219134425        0.1393063844    
 intlbfgs> Highest QCI image energy=    0.3442055712E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3442055712E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    370    0.3442055712E-04   -0.1000000000+201    0.3698308893E-01     0.000000000        0.1994618665E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8953516280     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.28397E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.33589E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219136804        0.1156481314    
 intlbfgs> Highest QCI image energy=    0.2839686877E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2839686877E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    371    0.2839686877E-04   -0.1000000000+201    0.3358923206E-01     0.000000000        0.7529995531E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956801184     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.34304E-04 d,ref,cutoff=     1.4362         1.7205        0.28316     max grad=    0.36921E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219134469        0.1386638085    
 intlbfgs> Highest QCI image energy=    0.3430429261E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3430429261E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    372    0.3430429261E-04   -0.1000000000+201    0.3692051685E-01     0.000000000        0.7286974803E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.8956796527     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.34233E-04 d,ref,cutoff=     1.4362         1.7205        0.28316     max grad=    0.36882E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219134489        0.1386478062    
 intlbfgs> Highest QCI image energy=    0.3423341470E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3423341470E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    373    0.3423341470E-04   -0.1000000000+201    0.3688232760E-01     0.000000000        0.5832233123E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956773506     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.33956E-04 d,ref,cutoff=     1.4362         1.7205        0.28316     max grad=    0.36732E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219134570        0.1385477057    
 intlbfgs> Highest QCI image energy=    0.3395570646E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3395570646E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    374    0.3395570646E-04   -0.1000000000+201    0.3673230400E-01     0.000000000        0.2069229143E-04        15     3
 intlbfgs> Mean deviation     0.1385477057     Decreasing QCI force constant to      1.422388463    
 intlbfgs> largest atomic distance between images is     0.8956867089     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.33828E-04 d,ref,cutoff=     1.4362         1.7205        0.28316     max grad=    0.36662E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219134596        0.1391525899    
 intlbfgs> Highest QCI image energy=    0.3382752825E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3382752825E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    375    0.3382752825E-04   -0.1000000000+201    0.3666195227E-01     0.000000000        0.1535640474E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8963085358     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.28728E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.33734E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219135732        0.1793051600    
 intlbfgs> Highest QCI image energy=    0.2872812239E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2872812239E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    376    0.2872812239E-04   -0.1000000000+201    0.3373360183E-01     0.000000000        0.1020554117E-02        15     3
 intlbfgs> largest atomic distance between images is     0.8957086938     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.33704E-04 d,ref,cutoff=     1.4362         1.7205        0.28316     max grad=    0.36593E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219134607        0.1405843469    
 intlbfgs> Highest QCI image energy=    0.3370361900E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3370361900E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    377    0.3370361900E-04   -0.1000000000+201    0.3659297067E-01     0.000000000        0.9867042634E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.8957085471     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.33655E-04 d,ref,cutoff=     1.4362         1.7205        0.28316     max grad=    0.36566E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219134621        0.1405833867    
 intlbfgs> Highest QCI image energy=    0.3365466152E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3365466152E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    378    0.3365466152E-04   -0.1000000000+201    0.3656634301E-01     0.000000000        0.3408465175E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8957088141     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.33305E-04 d,ref,cutoff=     1.4362         1.7205        0.28316     max grad=    0.36376E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219134720        0.1406589646    
 intlbfgs> Highest QCI image energy=    0.3330516821E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3330516821E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    379    0.3330516821E-04   -0.1000000000+201    0.3637558039E-01     0.000000000        0.2240753552E-04        15     3
 intlbfgs> Mean deviation     0.1406589646     Decreasing QCI force constant to      1.408305409    
 intlbfgs> largest atomic distance between images is     0.8957034291     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.33176E-04 d,ref,cutoff=     1.4362         1.7205        0.28316     max grad=    0.36305E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219134763        0.1402760208    
 intlbfgs> Highest QCI image energy=    0.3317619484E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3317619484E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    380    0.3317619484E-04   -0.1000000000+201    0.3630493639E-01     0.000000000        0.1393373429E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8955494261     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.31527E-04 d,ref,cutoff=     1.4362         1.7205        0.28316     max grad=    0.35391E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219135481        0.1293148121    
 intlbfgs> Highest QCI image energy=    0.3152710757E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3152710757E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    381    0.3152710757E-04   -0.1000000000+201    0.3539146348E-01     0.000000000        0.3905989026E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956900537     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.33128E-04 d,ref,cutoff=     1.4362         1.7205        0.28316     max grad=    0.36279E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219134793        0.1393368620    
 intlbfgs> Highest QCI image energy=    0.3312839800E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3312839800E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    382    0.3312839800E-04   -0.1000000000+201    0.3627910790E-01     0.000000000        0.3612945320E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.8956904168     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.33053E-04 d,ref,cutoff=     1.4362         1.7205        0.28316     max grad=    0.36238E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219134814        0.1393693760    
 intlbfgs> Highest QCI image energy=    0.3305324217E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3305324217E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    383    0.3305324217E-04   -0.1000000000+201    0.3623780032E-01     0.000000000        0.3278438203E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956904695     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.32481E-04 d,ref,cutoff=     1.4362         1.7205        0.28316     max grad=    0.35922E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219134979        0.1394196702    
 intlbfgs> Highest QCI image energy=    0.3248136713E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3248136713E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    384    0.3248136713E-04   -0.1000000000+201    0.3592198351E-01     0.000000000        0.1799437972E-04        15     3
 intlbfgs> Mean deviation     0.1394196702     Decreasing QCI force constant to      1.394361791    
 intlbfgs> largest atomic distance between images is     0.8956908734     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.32475E-04 d,ref,cutoff=     1.4362         1.7205        0.28316     max grad=    0.35918E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219134981        0.1394441193    
 intlbfgs> Highest QCI image energy=    0.3247465541E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3247465541E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    385    0.3247465541E-04   -0.1000000000+201    0.3591821751E-01     0.000000000        0.1135560148E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8957176464     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.32460E-04 d,ref,cutoff=     1.4362         1.7205        0.28316     max grad=    0.35907E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219134959        0.1410684154    
 intlbfgs> Highest QCI image energy=    0.3245980629E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3245980629E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    386    0.3245980629E-04   -0.1000000000+201    0.3590738291E-01     0.000000000        0.7240592646E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8957071235     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.32478E-04 d,ref,cutoff=     1.4362         1.7205        0.28316     max grad=    0.35919E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219134961        0.1405256880    
 intlbfgs> Highest QCI image energy=    0.3247849867E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3247849867E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    387    0.3247849867E-04   -0.1000000000+201    0.3591942379E-01     0.000000000        0.6464543143E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956896739     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.32486E-04 d,ref,cutoff=     1.4362         1.7205        0.28316     max grad=    0.35924E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219134979        0.1393402481    
 intlbfgs> Highest QCI image energy=    0.3248565085E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3248565085E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    388    0.3248565085E-04   -0.1000000000+201    0.3592422605E-01     0.000000000        0.2870290561E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956985350     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.32471E-04 d,ref,cutoff=     1.4362         1.7205        0.28316     max grad=    0.35916E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219134973        0.1399368223    
 intlbfgs> Highest QCI image energy=    0.3247108248E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3247108248E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    389    0.3247108248E-04   -0.1000000000+201    0.3591568071E-01     0.000000000        0.1381643778E-04        15     3
 intlbfgs> Mean deviation     0.1399368223     Decreasing QCI force constant to      1.380556229    
 intlbfgs> largest atomic distance between images is     0.8956306488     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.15639E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.24898E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140865        0.1356386571    
 intlbfgs> Highest QCI image energy=    0.1563870842E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1563870842E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    390    0.1563870842E-04   -0.1000000000+201    0.2489787047E-01     0.000000000        0.2752644033E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956983155     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.31802E-04 d,ref,cutoff=     1.4362         1.7205        0.28316     max grad=    0.35542E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219135169        0.1399296191    
 intlbfgs> Highest QCI image energy=    0.3180155482E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3180155482E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    391    0.3180155482E-04   -0.1000000000+201    0.3554204668E-01     0.000000000        0.2673553480E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956985877     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.31215E-04 d,ref,cutoff=     1.4362         1.7205        0.28316     max grad=    0.35211E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219135342        0.1399560260    
 intlbfgs> Highest QCI image energy=    0.3121472073E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3121472073E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    392    0.3121472073E-04   -0.1000000000+201    0.3521132324E-01     0.000000000        0.7422107758E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956985957     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.31216E-04 d,ref,cutoff=     1.4362         1.7205        0.28316     max grad=    0.35212E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219135342        0.1399565017    
 intlbfgs> Highest QCI image energy=    0.3121565282E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3121565282E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    393    0.3121565282E-04   -0.1000000000+201    0.3521185015E-01     0.000000000        0.2793772783E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8956986535     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.31218E-04 d,ref,cutoff=     1.4362         1.7205        0.28316     max grad=    0.35213E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219135341        0.1399599529    
 intlbfgs> Highest QCI image energy=    0.3121838520E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3121838520E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    394    0.3121838520E-04   -0.1000000000+201    0.3521339128E-01     0.000000000        0.1817369190E-06        15     3
 intlbfgs> Mean deviation     0.1399599529     Decreasing QCI force constant to      1.366887355    
 intlbfgs> largest atomic distance between images is     0.8956987443     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.31220E-04 d,ref,cutoff=     1.4362         1.7205        0.28316     max grad=    0.35214E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219135341        0.1399653924    
 intlbfgs> Highest QCI image energy=    0.3121953131E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3121953131E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    395    0.3121953131E-04   -0.1000000000+201    0.3521403086E-01     0.000000000        0.2846056715E-06        15     3
 intlbfgs> largest atomic distance between images is     0.8956996629     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.31218E-04 d,ref,cutoff=     1.4362         1.7205        0.28316     max grad=    0.35213E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219135340        0.1400206264    
 intlbfgs> Highest QCI image energy=    0.3121818571E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3121818571E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    396    0.3121818571E-04   -0.1000000000+201    0.3521317521E-01     0.000000000        0.2863964646E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956989506     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.31197E-04 d,ref,cutoff=     1.4362         1.7205        0.28316     max grad=    0.35201E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219135347        0.1399745408    
 intlbfgs> Highest QCI image energy=    0.3119678091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3119678091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    397    0.3119678091E-04   -0.1000000000+201    0.3520110137E-01     0.000000000        0.1163888033E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956884487     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.30735E-04 d,ref,cutoff=     1.4362         1.7205        0.28316     max grad=    0.34939E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219135497        0.1392763432    
 intlbfgs> Highest QCI image energy=    0.3073482260E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3073482260E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    398    0.3073482260E-04   -0.1000000000+201    0.3493903576E-01     0.000000000        0.1817839790E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956889768     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.30721E-04 d,ref,cutoff=     1.4362         1.7205        0.28316     max grad=    0.34931E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219135501        0.1393087095    
 intlbfgs> Highest QCI image energy=    0.3072079580E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3072079580E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    399    0.3072079580E-04   -0.1000000000+201    0.3493098180E-01     0.000000000        0.1450441060E-05        15     3
 intlbfgs> Mean deviation     0.1393087095     Decreasing QCI force constant to      1.353353817    
 intlbfgs> largest atomic distance between images is     0.8956952522     for atom     10 and images      2     3 total images=     1
 checkrep> number of active repulsions and total=      58      58
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.30676E-04 d,ref,cutoff=     1.4362         1.7205        0.28316     max grad=    0.34905E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219135507        0.1397235113    
 intlbfgs> Highest QCI image energy=    0.3067612129E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3067612129E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    400    0.3067612129E-04   -0.1000000000+201    0.3490511708E-01     0.000000000        0.9418018920E-05        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.8961117395     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.29029E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.33929E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219135646        0.1672775890    
 intlbfgs> Highest QCI image energy=    0.2902928217E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2902928217E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    401    0.2902928217E-04   -0.1000000000+201    0.3392875567E-01     0.000000000        0.6269279624E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8957059809     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.30652E-04 d,ref,cutoff=     1.4362         1.7205        0.28316     max grad=    0.34891E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219135502        0.1404558946    
 intlbfgs> Highest QCI image energy=    0.3065209154E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3065209154E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    402    0.3065209154E-04   -0.1000000000+201    0.3489095065E-01     0.000000000        0.6100219586E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8957073425     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.30647E-04 d,ref,cutoff=     1.4362         1.7205        0.28316     max grad=    0.34888E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219135503        0.1404790159    
 intlbfgs> Highest QCI image energy=    0.3064740770E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3064740770E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    403    0.3064740770E-04   -0.1000000000+201    0.3488770508E-01     0.000000000        0.3137904212E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8957056848     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.30605E-04 d,ref,cutoff=     1.4362         1.7205        0.28316     max grad=    0.34864E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219135516        0.1404283433    
 intlbfgs> Highest QCI image energy=    0.3060547242E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3060547242E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    404    0.3060547242E-04   -0.1000000000+201    0.3486426256E-01     0.000000000        0.2753381524E-04        15     3
 intlbfgs> Mean deviation     0.1404283433     Decreasing QCI force constant to      1.339954274    
 intlbfgs> largest atomic distance between images is     0.8955685787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.18659E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.27204E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219139735        0.1312416521    
 intlbfgs> Highest QCI image energy=    0.1865928850E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1865928850E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    405    0.1865928850E-04   -0.1000000000+201    0.2720431752E-01     0.000000000        0.3156531232E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956996661     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.30007E-04 d,ref,cutoff=     1.4362         1.7205        0.28316     max grad=    0.34521E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219135703        0.1400385147    
 intlbfgs> Highest QCI image energy=    0.3000689541E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3000689541E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    406    0.3000689541E-04   -0.1000000000+201    0.3452070110E-01     0.000000000        0.3046381203E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8956944326     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.29481E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.34216E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219135869        0.1396986740    
 intlbfgs> Highest QCI image energy=    0.2948120092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2948120092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    407    0.2948120092E-04   -0.1000000000+201    0.3421613712E-01     0.000000000        0.1089315527E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956948226     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.29478E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.34214E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219135870        0.1397245194    
 intlbfgs> Highest QCI image energy=    0.2947841110E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2947841110E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    408    0.2947841110E-04   -0.1000000000+201    0.3421449063E-01     0.000000000        0.5877496703E-06        15     3
 intlbfgs> largest atomic distance between images is     0.8957001044     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.29459E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.34203E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219135870        0.1400742948    
 intlbfgs> Highest QCI image energy=    0.2945872929E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2945872929E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    409    0.2945872929E-04   -0.1000000000+201    0.3420273292E-01     0.000000000        0.7962627229E-05        15     3
 intlbfgs> Mean deviation     0.1400742948     Decreasing QCI force constant to      1.326687400    
 intlbfgs> largest atomic distance between images is     0.8957001242     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.29459E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.34203E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219135870        0.1400753996    
 intlbfgs> Highest QCI image energy=    0.2945888240E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2945888240E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    410    0.2945888240E-04   -0.1000000000+201    0.3420281895E-01     0.000000000        0.1460072079E-06        15     3
 intlbfgs> largest atomic distance between images is     0.8957042833     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.29458E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.34201E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219135866        0.1403082341    
 intlbfgs> Highest QCI image energy=    0.2945752650E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2945752650E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    411    0.2945752650E-04   -0.1000000000+201    0.3420136415E-01     0.000000000        0.3031865988E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8957010865     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.29458E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.34202E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219135869        0.1401389437    
 intlbfgs> Highest QCI image energy=    0.2945833404E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2945833404E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    412    0.2945833404E-04   -0.1000000000+201    0.3420244391E-01     0.000000000        0.3007948662E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956997220     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.29458E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.34203E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219135870        0.1400485545    
 intlbfgs> Highest QCI image energy=    0.2945834029E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2945834029E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    413    0.2945834029E-04   -0.1000000000+201    0.3420252230E-01     0.000000000        0.2063538974E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8957001602     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.29458E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.34202E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219135870        0.1400776369    
 intlbfgs> Highest QCI image energy=    0.2945771341E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2945771341E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    414    0.2945771341E-04   -0.1000000000+201    0.3420213310E-01     0.000000000        0.6594669822E-06        15     3
 intlbfgs> Mean deviation     0.1400776369     Decreasing QCI force constant to      1.313551881    
 intlbfgs> largest atomic distance between images is     0.8956391135     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.14150E-04 d,ref,cutoff=     1.4366         1.7205        0.28316     max grad=    0.23680E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219141501        0.1362322502    
 intlbfgs> Highest QCI image energy=    0.1414984582E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1414984582E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    415    0.1414984582E-04   -0.1000000000+201    0.2367958249E-01     0.000000000        0.2608118715E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8957005975     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.28877E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.33862E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219136048        0.1401132840    
 intlbfgs> Highest QCI image energy=    0.2887651136E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2887651136E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    416    0.2887651136E-04   -0.1000000000+201    0.3386177132E-01     0.000000000        0.2539830807E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8957010146     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.28342E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.33546E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219136214        0.1401471314    
 intlbfgs> Highest QCI image energy=    0.2834176297E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2834176297E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    417    0.2834176297E-04   -0.1000000000+201    0.3354559734E-01     0.000000000        0.7051507098E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8957010177     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.28343E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.33546E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219136214        0.1401473256    
 intlbfgs> Highest QCI image energy=    0.2834259409E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2834259409E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    418    0.2834259409E-04   -0.1000000000+201    0.3354609080E-01     0.000000000        0.1251556794E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8957010182     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.28343E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.33546E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219136214        0.1401473542    
 intlbfgs> Highest QCI image energy=    0.2834262966E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2834262966E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    419    0.2834262966E-04   -0.1000000000+201    0.3354611186E-01     0.000000000        0.2606657138E-08        15     3
 intlbfgs> Mean deviation     0.1401473542     Decreasing QCI force constant to      1.300546417    
 intlbfgs> largest atomic distance between images is     0.8957010278     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.28343E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.33546E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219136213        0.1401478798    
 intlbfgs> Highest QCI image energy=    0.2834290846E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2834290846E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    420    0.2834290846E-04   -0.1000000000+201    0.3354627610E-01     0.000000000        0.5775821138E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8957010665     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.28343E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.33546E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219136213        0.1401499639    
 intlbfgs> Highest QCI image energy=    0.2834262622E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2834262622E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    421    0.2834262622E-04   -0.1000000000+201    0.3354610254E-01     0.000000000        0.2606322811E-06        15     3
 intlbfgs> largest atomic distance between images is     0.8957006677     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.28310E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.33527E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219136224        0.1401164651    
 intlbfgs> Highest QCI image energy=    0.2831016659E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2831016659E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    422    0.2831016659E-04   -0.1000000000+201    0.3352678098E-01     0.000000000        0.4069230293E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956951132     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.28081E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.33391E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219136303        0.1397315789    
 intlbfgs> Highest QCI image energy=    0.2808108435E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2808108435E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    423    0.2808108435E-04   -0.1000000000+201    0.3339051541E-01     0.000000000        0.1413355066E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956908980     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.27957E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.33316E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219136346        0.1394606334    
 intlbfgs> Highest QCI image energy=    0.2795659143E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2795659143E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    424    0.2795659143E-04   -0.1000000000+201    0.3331643200E-01     0.000000000        0.7411631789E-05        15     3
 intlbfgs> Mean deviation     0.1394606334     Decreasing QCI force constant to      1.287669720    
 intlbfgs> largest atomic distance between images is     0.8956940255     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.27893E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.33278E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219136362        0.1396979348    
 intlbfgs> Highest QCI image energy=    0.2789262686E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2789262686E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    425    0.2789262686E-04   -0.1000000000+201    0.3327821478E-01     0.000000000        0.1655048764E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8961805913     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.15779E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25017E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219143230        0.1770497591    
 intlbfgs> Highest QCI image energy=    0.1577939094E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1577939094E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    426    0.1577939094E-04   -0.1000000000+201    0.2501715134E-01     0.000000000        0.2845622815E-02        15     3
 intlbfgs> largest atomic distance between images is     0.8957035502     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.27794E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.33219E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219136382        0.1403550469    
 intlbfgs> Highest QCI image energy=    0.2779363735E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2779363735E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    427    0.2779363735E-04   -0.1000000000+201    0.3321857099E-01     0.000000000        0.2828460415E-02        15     3
 intlbfgs> largest atomic distance between images is     0.8957072292     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.27777E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.33208E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219136383        0.1405949941    
 intlbfgs> Highest QCI image energy=    0.2777716582E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2777716582E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    428    0.2777716582E-04   -0.1000000000+201    0.3320845912E-01     0.000000000        0.5754167879E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8957111243     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.27710E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.33168E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219136400        0.1408468430    
 intlbfgs> Highest QCI image energy=    0.2771018307E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2771018307E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    429    0.2771018307E-04   -0.1000000000+201    0.3316798328E-01     0.000000000        0.6729446150E-05        15     3
 intlbfgs> Mean deviation     0.1408468430     Decreasing QCI force constant to      1.274920515    
 intlbfgs> largest atomic distance between images is     0.8956901656     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.27090E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.32794E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219136621        0.1394382392    
 intlbfgs> Highest QCI image energy=    0.2708983822E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2708983822E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    430    0.2708983822E-04   -0.1000000000+201    0.3279420026E-01     0.000000000        0.3681497246E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8957020523     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.25624E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.31890E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219137084        0.1401910779    
 intlbfgs> Highest QCI image energy=    0.2562357068E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2562357068E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    431    0.2562357068E-04   -0.1000000000+201    0.3189019496E-01     0.000000000        0.3743620587E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8957019700     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.26763E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.32594E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219136713        0.1402146179    
 intlbfgs> Highest QCI image energy=    0.2676306509E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2676306509E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    432    0.2676306509E-04   -0.1000000000+201    0.3259439729E-01     0.000000000        0.2790721831E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8957019934     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.26760E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.32592E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219136714        0.1402201654    
 intlbfgs> Highest QCI image energy=    0.2675990264E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2675990264E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    433    0.2675990264E-04   -0.1000000000+201    0.3259249368E-01     0.000000000        0.2128691942E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8957023558     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.26745E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.32584E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219136718        0.1402543834    
 intlbfgs> Highest QCI image energy=    0.2674545336E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2674545336E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    434    0.2674545336E-04   -0.1000000000+201    0.3258372035E-01     0.000000000        0.5539075470E-05        15     3
 intlbfgs> Mean deviation     0.1402543834     Decreasing QCI force constant to      1.262297539    
 intlbfgs> largest atomic distance between images is     0.8957023406     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.26746E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.32584E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219136718        0.1402533461    
 intlbfgs> Highest QCI image energy=    0.2674560790E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2674560790E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    435    0.2674560790E-04   -0.1000000000+201    0.3258381560E-01     0.000000000        0.2125096977E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8957022835     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.26745E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.32584E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219136718        0.1402494391    
 intlbfgs> Highest QCI image energy=    0.2674545309E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2674545309E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    436    0.2674545309E-04   -0.1000000000+201    0.3258372391E-01     0.000000000        0.8061826498E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8957043645     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.26117E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.32198E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219136918        0.1404701178    
 intlbfgs> Highest QCI image energy=    0.2611699751E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2611699751E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    437    0.2611699751E-04   -0.1000000000+201    0.3219774806E-01     0.000000000        0.4281506153E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8957011611     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.26295E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.32307E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219136864        0.1401907357    
 intlbfgs> Highest QCI image energy=    0.2629507290E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2629507290E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    438    0.2629507290E-04   -0.1000000000+201    0.3230740168E-01     0.000000000        0.3475245328E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8957021646     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.26284E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.32301E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219136867        0.1402503557    
 intlbfgs> Highest QCI image energy=    0.2628414461E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2628414461E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    439    0.2628414461E-04   -0.1000000000+201    0.3230053923E-01     0.000000000        0.5465957954E-05        15     3
 intlbfgs> Mean deviation     0.1402503557     Decreasing QCI force constant to      1.249799544    
 intlbfgs> largest atomic distance between images is     0.8957046236     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.26113E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.32195E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219136920        0.1404206593    
 intlbfgs> Highest QCI image energy=    0.2611335383E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2611335383E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    440    0.2611335383E-04   -0.1000000000+201    0.3219493715E-01     0.000000000        0.4045602737E-05        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.8957071064     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.25916E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.32073E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219136981        0.1405967739    
 intlbfgs> Highest QCI image energy=    0.2591632564E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2591632564E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    441    0.2591632564E-04   -0.1000000000+201    0.3207273550E-01     0.000000000        0.5062984245E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8957089607     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.25751E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.31970E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219137033        0.1407195910    
 intlbfgs> Highest QCI image energy=    0.2575095522E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2575095522E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    442    0.2575095522E-04   -0.1000000000+201    0.3196974956E-01     0.000000000        0.4582150915E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8957086021     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.25740E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.31963E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219137037        0.1406946091    
 intlbfgs> Highest QCI image energy=    0.2573981584E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2573981584E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    443    0.2573981584E-04   -0.1000000000+201    0.3196282310E-01     0.000000000        0.6464762848E-06        15     3
 intlbfgs> largest atomic distance between images is     0.8957055930     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.25711E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.31945E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219137050        0.1404865626    
 intlbfgs> Highest QCI image energy=    0.2571064691E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2571064691E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    444    0.2571064691E-04   -0.1000000000+201    0.3194477288E-01     0.000000000        0.4604281897E-05        15     3
 intlbfgs> Mean deviation     0.1404865626     Decreasing QCI force constant to      1.237425291    
 intlbfgs> largest atomic distance between images is     0.8957037240     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.25720E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.31951E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219137049        0.1403577564    
 intlbfgs> Highest QCI image energy=    0.2571996046E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2571996046E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    445    0.2571996046E-04   -0.1000000000+201    0.3195066394E-01     0.000000000        0.2698494648E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956924345     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.25701E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.31939E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219137069        0.1395780412    
 intlbfgs> Highest QCI image energy=    0.2570055949E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2570055949E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    446    0.2570055949E-04   -0.1000000000+201    0.3193906589E-01     0.000000000        0.1675700991E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8957026487     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.25674E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.31922E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219137066        0.1402661748    
 intlbfgs> Highest QCI image energy=    0.2567444311E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2567444311E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    447    0.2567444311E-04   -0.1000000000+201    0.3192218811E-01     0.000000000        0.1532547107E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8957046566     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.25636E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.31898E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219137076        0.1404037272    
 intlbfgs> Highest QCI image energy=    0.2563554775E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2563554775E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    448    0.2563554775E-04   -0.1000000000+201    0.3189781570E-01     0.000000000        0.2841144317E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8957095895     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.25308E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.31692E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219137178        0.1407532109    
 intlbfgs> Highest QCI image energy=    0.2530770760E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2530770760E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    449    0.2530770760E-04   -0.1000000000+201    0.3169232943E-01     0.000000000        0.1043813489E-04        15     3
 intlbfgs> Mean deviation     0.1407532109     Decreasing QCI force constant to      1.225173555    
 intlbfgs> largest atomic distance between images is     0.8957032962     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.25235E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.31647E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219137210        0.1403302622    
 intlbfgs> Highest QCI image energy=    0.2523466981E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2523466981E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    450    0.2523466981E-04   -0.1000000000+201    0.3164676719E-01     0.000000000        0.9625157261E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956665568     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.25174E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.31611E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219137273        0.1378473941    
 intlbfgs> Highest QCI image energy=    0.2517446216E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2517446216E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    451    0.2517446216E-04   -0.1000000000+201    0.3161087689E-01     0.000000000        0.5345029393E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956981743     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.25206E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.31629E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219137226        0.1399653571    
 intlbfgs> Highest QCI image energy=    0.2520569287E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2520569287E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    452    0.2520569287E-04   -0.1000000000+201    0.3162863303E-01     0.000000000        0.5095660179E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8957147928     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.25212E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.31632E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219137204        0.1411664582    
 intlbfgs> Highest QCI image energy=    0.2521159897E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2521159897E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    453    0.2521159897E-04   -0.1000000000+201    0.3163212623E-01     0.000000000        0.5132168838E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8957142814     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.23201E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.30340E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219137885        0.1410941343    
 intlbfgs> Highest QCI image energy=    0.2320114548E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2320114548E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    454    0.2320114548E-04   -0.1000000000+201    0.3033997015E-01     0.000000000        0.4779033933E-04        15     3
 intlbfgs> Mean deviation     0.1410941343     Decreasing QCI force constant to      1.213043124    
 intlbfgs> largest atomic distance between images is     0.8957039816     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.24754E-04 d,ref,cutoff=     1.4363         1.7205        0.28316     max grad=    0.31343E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219137369        0.1403839848    
 intlbfgs> Highest QCI image energy=    0.2475357802E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2475357802E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    455    0.2475357802E-04   -0.1000000000+201    0.3134258548E-01     0.000000000        0.2609922148E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8957042996     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.24389E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.31110E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219137491        0.1404092322    
 intlbfgs> Highest QCI image energy=    0.2438868994E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2438868994E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    456    0.2438868994E-04   -0.1000000000+201    0.3110991574E-01     0.000000000        0.5193346036E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8957043940     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.24279E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.31040E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219137528        0.1404167880    
 intlbfgs> Highest QCI image energy=    0.2427886483E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2427886483E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    457    0.2427886483E-04   -0.1000000000+201    0.3103954827E-01     0.000000000        0.1570622624E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8957043945     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.24279E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.31040E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219137528        0.1404168706    
 intlbfgs> Highest QCI image energy=    0.2427885551E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2427885551E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    458    0.2427885551E-04   -0.1000000000+201    0.3103954234E-01     0.000000000        0.9180940518E-08        15     3
 intlbfgs> largest atomic distance between images is     0.8957044118     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.24279E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.31040E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219137528        0.1404201527    
 intlbfgs> Highest QCI image energy=    0.2427885075E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2427885075E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    459    0.2427885075E-04   -0.1000000000+201    0.3103954151E-01     0.000000000        0.3820691607E-06        15     3
 intlbfgs> Mean deviation     0.1404201527     Decreasing QCI force constant to      1.201032796    
 intlbfgs> largest atomic distance between images is     0.8957044117     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.24279E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.31040E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219137528        0.1404201447    
 intlbfgs> Highest QCI image energy=    0.2427885167E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2427885167E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    460    0.2427885167E-04   -0.1000000000+201    0.3103954210E-01     0.000000000        0.1852492210E-09        15     3
 intlbfgs> largest atomic distance between images is     0.8957044113     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.24279E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.31040E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219137528        0.1404201162    
 intlbfgs> Highest QCI image energy=    0.2427885075E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2427885075E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    461    0.2427885075E-04   -0.1000000000+201    0.3103954153E-01     0.000000000        0.6698707668E-09        15     3
 intlbfgs> largest atomic distance between images is     0.8957091943     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.23404E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.30473E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219137820        0.1408058811    
 intlbfgs> Highest QCI image energy=    0.2340402741E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2340402741E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    462    0.2340402741E-04   -0.1000000000+201    0.3047318780E-01     0.000000000        0.1638101680E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8957048222     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.23813E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.30739E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219137686        0.1404536320    
 intlbfgs> Highest QCI image energy=    0.2381320323E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2381320323E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    463    0.2381320323E-04   -0.1000000000+201    0.3073941967E-01     0.000000000        0.1193371810E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8957048342     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.23813E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.30740E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219137686        0.1404544184    
 intlbfgs> Highest QCI image energy=    0.2381333816E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2381333816E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    464    0.2381333816E-04   -0.1000000000+201    0.3073950654E-01     0.000000000        0.2156386912E-07        15     3
 intlbfgs> Mean deviation     0.1404544184     Decreasing QCI force constant to      1.189141382    
 intlbfgs> largest atomic distance between images is     0.8957048385     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.23813E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.30740E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219137686        0.1404546221    
 intlbfgs> Highest QCI image energy=    0.2381336394E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2381336394E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    465    0.2381336394E-04   -0.1000000000+201    0.3073952300E-01     0.000000000        0.1913384575E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8957056548     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.23813E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.30739E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219137685        0.1404945218    
 intlbfgs> Highest QCI image energy=    0.2381332140E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2381332140E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    466    0.2381332140E-04   -0.1000000000+201    0.3073945046E-01     0.000000000        0.3562876682E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8957048459     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.23813E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.30739E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219137686        0.1404546214    
 intlbfgs> Highest QCI image energy=    0.2381332349E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2381332349E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    467    0.2381332349E-04   -0.1000000000+201    0.3073949651E-01     0.000000000        0.3454570233E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8957037241     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.23813E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.30739E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219137687        0.1403734431    
 intlbfgs> Highest QCI image energy=    0.2381293906E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2381293906E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    468    0.2381293906E-04   -0.1000000000+201    0.3073929463E-01     0.000000000        0.1693658819E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8957040161     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.23812E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.30739E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219137687        0.1403970822    
 intlbfgs> Highest QCI image energy=    0.2381182311E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2381182311E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    469    0.2381182311E-04   -0.1000000000+201    0.3073857437E-01     0.000000000        0.1179272169E-05        15     3
 intlbfgs> Mean deviation     0.1403970822     Decreasing QCI force constant to      1.177367705    
 intlbfgs> largest atomic distance between images is     0.8957020509     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.11383E-04 d,ref,cutoff=     1.4367         1.7205        0.28316     max grad=    0.21230E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219142739        0.1400524060    
 intlbfgs> Highest QCI image energy=    0.1138329817E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1138329817E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    470    0.1138329817E-04   -0.1000000000+201    0.2122976431E-01     0.000000000        0.2481498896E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8957051179     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.23341E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.30432E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219137848        0.1404779598    
 intlbfgs> Highest QCI image energy=    0.2334091750E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2334091750E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    471    0.2334091750E-04   -0.1000000000+201    0.3043203347E-01     0.000000000        0.2420798629E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8957057414     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.22907E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.30147E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219137997        0.1405256272    
 intlbfgs> Highest QCI image energy=    0.2290739825E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2290739825E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    472    0.2290739825E-04   -0.1000000000+201    0.3014712878E-01     0.000000000        0.6371290172E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8957057400     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.22908E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.30148E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219137997        0.1405255526    
 intlbfgs> Highest QCI image energy=    0.2290798344E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2290798344E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    473    0.2290798344E-04   -0.1000000000+201    0.3014751533E-01     0.000000000        0.1349685995E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8957057368     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.22908E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.30148E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219137997        0.1405253470    
 intlbfgs> Highest QCI image energy=    0.2290810720E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2290810720E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    474    0.2290810720E-04   -0.1000000000+201    0.3014759727E-01     0.000000000        0.7803867910E-08        15     3
 intlbfgs> Mean deviation     0.1405253470     Decreasing QCI force constant to      1.165710599    
 intlbfgs> largest atomic distance between images is     0.8957057097     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.22909E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.30148E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219137997        0.1405235603    
 intlbfgs> Highest QCI image energy=    0.2290850737E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2290850737E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    475    0.2290850737E-04   -0.1000000000+201    0.3014786335E-01     0.000000000        0.5704878361E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8957056630     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.22908E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.30148E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219137997        0.1405204562    
 intlbfgs> Highest QCI image energy=    0.2290810714E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2290810714E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    476    0.2290810714E-04   -0.1000000000+201    0.3014760223E-01     0.000000000        0.9039863731E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8956978599     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.22753E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.30046E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219138060        0.1399924530    
 intlbfgs> Highest QCI image energy=    0.2275313908E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2275313908E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    477    0.2275313908E-04   -0.1000000000+201    0.3004558365E-01     0.000000000        0.1311915498E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956960255     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.22580E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.29931E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219138123        0.1398551781    
 intlbfgs> Highest QCI image energy=    0.2258042323E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2258042323E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    478    0.2258042323E-04   -0.1000000000+201    0.2993098835E-01     0.000000000        0.5313229235E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8956989236     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.22495E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.29874E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219138150        0.1400385232    
 intlbfgs> Highest QCI image energy=    0.2249453811E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2249453811E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    479    0.2249453811E-04   -0.1000000000+201    0.2987358193E-01     0.000000000        0.8603359257E-05        15     3
 intlbfgs> Mean deviation     0.1400385232     Decreasing QCI force constant to      1.154168910    
 intlbfgs> largest atomic distance between images is     0.8957026708     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.22506E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.29881E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219138141        0.1402955391    
 intlbfgs> Highest QCI image energy=    0.2250615137E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2250615137E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    480    0.2250615137E-04   -0.1000000000+201    0.2988111247E-01     0.000000000        0.5683225330E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8957339784     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.22433E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.29831E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219138131        0.1424277332    
 intlbfgs> Highest QCI image energy=    0.2243339065E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2243339065E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    481    0.2243339065E-04   -0.1000000000+201    0.2983081548E-01     0.000000000        0.4980777734E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8957130470     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.22474E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.29859E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219138140        0.1410554087    
 intlbfgs> Highest QCI image energy=    0.2247382692E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2247382692E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    482    0.2247382692E-04   -0.1000000000+201    0.2985925921E-01     0.000000000        0.4565091476E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8956730127     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.22452E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.29846E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219138199        0.1381135445    
 intlbfgs> Highest QCI image energy=    0.2245202028E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2245202028E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    483    0.2245202028E-04   -0.1000000000+201    0.2984588496E-01     0.000000000        0.7456090144E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8957069237     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.22425E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.29827E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219138165        0.1406045428    
 intlbfgs> Highest QCI image energy=    0.2242506636E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2242506636E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    484    0.2242506636E-04   -0.1000000000+201    0.2982691418E-01     0.000000000        0.6279094626E-04        15     3
 intlbfgs> Mean deviation     0.1406045428     Decreasing QCI force constant to      1.142741495    
 intlbfgs> largest atomic distance between images is     0.8956184714     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.93838E-05 d,ref,cutoff=     1.4367         1.7205        0.28316     max grad=    0.19275E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219143877        0.1347309718    
 intlbfgs> Highest QCI image energy=    0.9383810209E-05 images=       1
 intlbfgs> Highest image        2 energy     0.9383810209E-05 is      0.000000000     sigma from the mean
 intlbfgs> steps:    485    0.9383810209E-05   -0.1000000000+201    0.1927543777E-01     0.000000000        0.2849142122E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8957064089     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.22025E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.29559E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219138306        0.1405809115    
 intlbfgs> Highest QCI image energy=    0.2202526583E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2202526583E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    486    0.2202526583E-04   -0.1000000000+201    0.2955904280E-01     0.000000000        0.2785930914E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8957050878     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.21616E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.29282E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219138454        0.1404998242    
 intlbfgs> Highest QCI image energy=    0.2161612836E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2161612836E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    487    0.2161612836E-04   -0.1000000000+201    0.2928243074E-01     0.000000000        0.7195224370E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8957051402     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.21617E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.29283E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219138454        0.1405032603    
 intlbfgs> Highest QCI image energy=    0.2161654479E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2161654479E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    488    0.2161654479E-04   -0.1000000000+201    0.2928271008E-01     0.000000000        0.1139212527E-06        15     3
 intlbfgs> largest atomic distance between images is     0.8957067680     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.21616E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.29282E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219138452        0.1406102091    
 intlbfgs> Highest QCI image energy=    0.2161563281E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2161563281E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    489    0.2161563281E-04   -0.1000000000+201    0.2928197849E-01     0.000000000        0.3488551909E-05        15     3
 intlbfgs> Mean deviation     0.1406102091     Decreasing QCI force constant to      1.131427223    
 intlbfgs> largest atomic distance between images is     0.8957067973     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.21613E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.29280E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219138453        0.1406119810    
 intlbfgs> Highest QCI image energy=    0.2161343225E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2161343225E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    490    0.2161343225E-04   -0.1000000000+201    0.2928048073E-01     0.000000000        0.9160939545E-07        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.8957067849     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.21611E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.29279E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219138454        0.1406110286    
 intlbfgs> Highest QCI image energy=    0.2161122061E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2161122061E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    491    0.2161122061E-04   -0.1000000000+201    0.2927897830E-01     0.000000000        0.4041016539E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8957054163     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.21201E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.28999E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219138604        0.1404966388    
 intlbfgs> Highest QCI image energy=    0.2120138419E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2120138419E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    492    0.2120138419E-04   -0.1000000000+201    0.2899916795E-01     0.000000000        0.7252204151E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8957053716     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.21201E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.28999E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219138604        0.1404946837    
 intlbfgs> Highest QCI image energy=    0.2120125172E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2120125172E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    493    0.2120125172E-04   -0.1000000000+201    0.2899908250E-01     0.000000000        0.2493735855E-06        15     3
 intlbfgs> largest atomic distance between images is     0.8957075200     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.21197E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.28996E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219138602        0.1406693029    
 intlbfgs> Highest QCI image energy=    0.2119741793E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2119741793E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    494    0.2119741793E-04   -0.1000000000+201    0.2899638691E-01     0.000000000        0.4067260697E-05        15     3
 intlbfgs> Mean deviation     0.1406693029     Decreasing QCI force constant to      1.120224973    
 intlbfgs> largest atomic distance between images is     0.8957071707     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.21198E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.28997E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219138602        0.1406421849    
 intlbfgs> Highest QCI image energy=    0.2119829346E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2119829346E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    495    0.2119829346E-04   -0.1000000000+201    0.2899700208E-01     0.000000000        0.5510246701E-06        15     3
 intlbfgs> largest atomic distance between images is     0.8956963189     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.21195E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.28995E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219138618        0.1397996027    
 intlbfgs> Highest QCI image energy=    0.2119529762E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2119529762E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    496    0.2119529762E-04   -0.1000000000+201    0.2899539481E-01     0.000000000        0.1715962745E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8957058921     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.21180E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.28985E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219138610        0.1405709251    
 intlbfgs> Highest QCI image energy=    0.2118045433E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2118045433E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    497    0.2118045433E-04   -0.1000000000+201    0.2898486980E-01     0.000000000        0.1687155122E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8957084456     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.21162E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.28972E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219138613        0.1407632627    
 intlbfgs> Highest QCI image energy=    0.2116191725E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2116191725E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    498    0.2116191725E-04   -0.1000000000+201    0.2897202193E-01     0.000000000        0.3902337623E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8957162541     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.21054E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.28897E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219138643        0.1413219048    
 intlbfgs> Highest QCI image energy=    0.2105379086E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2105379086E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    499    0.2105379086E-04   -0.1000000000+201    0.2889723674E-01     0.000000000        0.1307479097E-04        15     3
 intlbfgs> Mean deviation     0.1413219048     Decreasing QCI force constant to      1.109133637    
 intlbfgs> largest atomic distance between images is     0.8956946930     for atom     10 and images      2     3 total images=     1
 checkrep> number of active repulsions and total=      58      58
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.20621E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.28599E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219138830        0.1396758984    
 intlbfgs> Highest QCI image energy=    0.2062117193E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2062117193E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    500    0.2062117193E-04   -0.1000000000+201    0.2859882115E-01     0.000000000        0.3457103566E-04        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.8956935738     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.19789E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.28014E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219139141        0.1395172772    
 intlbfgs> Highest QCI image energy=    0.1978943912E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1978943912E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    501    0.1978943912E-04   -0.1000000000+201    0.2801422687E-01     0.000000000        0.1864393697E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8957050643     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.20406E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.28448E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219138896        0.1404323157    
 intlbfgs> Highest QCI image energy=    0.2040581704E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2040581704E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    502    0.2040581704E-04   -0.1000000000+201    0.2844808947E-01     0.000000000        0.2263621935E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8957067391     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.20407E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.28449E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219138893        0.1405626717    
 intlbfgs> Highest QCI image energy=    0.2040662494E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2040662494E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    503    0.2040662494E-04   -0.1000000000+201    0.2844858669E-01     0.000000000        0.2664806012E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8957071863     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.20375E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.28426E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219138903        0.1406718050    
 intlbfgs> Highest QCI image energy=    0.2037469546E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2037469546E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    504    0.2037469546E-04   -0.1000000000+201    0.2842640846E-01     0.000000000        0.1302168782E-04        15     3
 intlbfgs> Mean deviation     0.1406718050     Decreasing QCI force constant to      1.098152116    
 intlbfgs> largest atomic distance between images is     0.8957078576     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.20391E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.28438E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219138897        0.1406990237    
 intlbfgs> Highest QCI image energy=    0.2039121638E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2039121638E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    505    0.2039121638E-04   -0.1000000000+201    0.2843788243E-01     0.000000000        0.4082195612E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8957094251     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.20366E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.28420E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219138905        0.1407538148    
 intlbfgs> Highest QCI image energy=    0.2036597610E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2036597610E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    506    0.2036597610E-04   -0.1000000000+201    0.2842000421E-01     0.000000000        0.1099480520E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8957041498     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.19925E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.28110E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219139075        0.1404221600    
 intlbfgs> Highest QCI image energy=    0.1992534337E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1992534337E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    507    0.1992534337E-04   -0.1000000000+201    0.2811032315E-01     0.000000000        0.1598262412E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8957054002     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.20004E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.28166E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219139044        0.1405061263    
 intlbfgs> Highest QCI image energy=    0.2000429060E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2000429060E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    508    0.2000429060E-04   -0.1000000000+201    0.2816604722E-01     0.000000000        0.2967779910E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8957055167     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.20006E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.28167E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219139043        0.1405148604    
 intlbfgs> Highest QCI image energy=    0.2000634523E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2000634523E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    509    0.2000634523E-04   -0.1000000000+201    0.2816749257E-01     0.000000000        0.1845272630E-06        15     3
 intlbfgs> Mean deviation     0.1405148604     Decreasing QCI force constant to      1.087279323    
 intlbfgs> largest atomic distance between images is     0.8957068225     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.20015E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.28174E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219139038        0.1406150197    
 intlbfgs> Highest QCI image energy=    0.2001526012E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2001526012E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    510    0.2001526012E-04   -0.1000000000+201    0.2817372972E-01     0.000000000        0.2022320773E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8957100006     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.20005E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.28166E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219139037        0.1408641359    
 intlbfgs> Highest QCI image energy=    0.2000502250E-04 images=       1
 intlbfgs> Highest image        2 energy     0.2000502250E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    511    0.2000502250E-04   -0.1000000000+201    0.2816637369E-01     0.000000000        0.5017347430E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8957111510     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.19928E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.28112E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219139063        0.1410313732    
 intlbfgs> Highest QCI image energy=    0.1992789009E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1992789009E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    512    0.1992789009E-04   -0.1000000000+201    0.2811198133E-01     0.000000000        0.1348677785E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8957093702     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.19880E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.28078E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219139083        0.1409241328    
 intlbfgs> Highest QCI image energy=    0.1988004865E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1988004865E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    513    0.1988004865E-04   -0.1000000000+201    0.2807825647E-01     0.000000000        0.5491097420E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8957064235     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.19797E-04 d,ref,cutoff=     1.4364         1.7205        0.28316     max grad=    0.28020E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219139118        0.1407161262    
 intlbfgs> Highest QCI image energy=    0.1979746401E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1979746401E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    514    0.1979746401E-04   -0.1000000000+201    0.2801986475E-01     0.000000000        0.5469233212E-05        15     3
 intlbfgs> Mean deviation     0.1407161262     Decreasing QCI force constant to      1.076514181    
 intlbfgs> largest atomic distance between images is     0.8957050517     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.19642E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.27909E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219139180        0.1404924047    
 intlbfgs> Highest QCI image energy=    0.1964203860E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1964203860E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    515    0.1964203860E-04   -0.1000000000+201    0.2790911553E-01     0.000000000        0.2043540470E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8985906443     for atom     10 and images      1     2 total images=     1
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=     1.221186124        0.5760130990    
 intlbfgs> Highest QCI image energy=     0.000000000     images=       1
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:    516   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.6770648099E-01        15     3
 intlbfgs> largest atomic distance between images is     0.8957262786     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.19398E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.27733E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219139249        0.1418770701    
 intlbfgs> Highest QCI image energy=    0.1939796164E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1939796164E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    517    0.1939796164E-04   -0.1000000000+201    0.2773318317E-01     0.000000000        0.6767177226E-01        15     3
 intlbfgs> largest atomic distance between images is     0.8955682453     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.19504E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.27817E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219139421        0.1301387501    
 intlbfgs> Highest QCI image energy=    0.1950432660E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1950432660E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    518    0.1950432660E-04   -0.1000000000+201    0.2781705870E-01     0.000000000        0.2461102295E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8957077597     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.19524E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.27824E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219139223        0.1405913981    
 intlbfgs> Highest QCI image energy=    0.1952358209E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1952358209E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    519    0.1952358209E-04   -0.1000000000+201    0.2782421121E-01     0.000000000        0.2154405305E-03        15     3
 intlbfgs> Mean deviation     0.1405913981     Decreasing QCI force constant to      1.065855625    
 intlbfgs> largest atomic distance between images is     0.8957369742     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.86571E-05 d,ref,cutoff=     1.4367         1.7205        0.28316     max grad=    0.18509E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219144129        0.1435111921    
 intlbfgs> Highest QCI image energy=    0.8657087616E-05 images=       1
 intlbfgs> Highest image        2 energy     0.8657087616E-05 is      0.000000000     sigma from the mean
 intlbfgs> steps:    520    0.8657087616E-05   -0.1000000000+201    0.1850925009E-01     0.000000000        0.2362220673E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8957090320     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.19229E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.27613E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219139331        0.1407947332    
 intlbfgs> Highest QCI image energy=    0.1922872720E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1922872720E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    521    0.1922872720E-04   -0.1000000000+201    0.2761284390E-01     0.000000000        0.2242054123E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8957095651     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.18868E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.27352E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219139468        0.1408519257    
 intlbfgs> Highest QCI image energy=    0.1886848662E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1886848662E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    522    0.1886848662E-04   -0.1000000000+201    0.2735219650E-01     0.000000000        0.6360034573E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8957095559     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.18869E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.27352E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219139468        0.1408507403    
 intlbfgs> Highest QCI image energy=    0.1886888772E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1886888772E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    523    0.1886888772E-04   -0.1000000000+201    0.2735248748E-01     0.000000000        0.8035895087E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8957092735     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.18871E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.27354E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219139468        0.1408132553    
 intlbfgs> Highest QCI image energy=    0.1887055576E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1887055576E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    524    0.1887055576E-04   -0.1000000000+201    0.2735367922E-01     0.000000000        0.2636118423E-05        15     3
 intlbfgs> Mean deviation     0.1408132553     Decreasing QCI force constant to      1.055302599    
 intlbfgs> largest atomic distance between images is     0.8957093695     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.18867E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.27351E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219139469        0.1408190613    
 intlbfgs> Highest QCI image energy=    0.1886736598E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1886736598E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    525    0.1886736598E-04   -0.1000000000+201    0.2735135299E-01     0.000000000        0.2814400261E-06        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.8957094422     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.18864E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.27349E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219139470        0.1408251643    
 intlbfgs> Highest QCI image energy=    0.1886414767E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1886414767E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    526    0.1886414767E-04   -0.1000000000+201    0.2734901116E-01     0.000000000        0.1517475550E-06        15     3
 intlbfgs> largest atomic distance between images is     0.8957163571     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.18525E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.27101E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219139593        0.1413370475    
 intlbfgs> Highest QCI image energy=    0.1852506892E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1852506892E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    527    0.1852506892E-04   -0.1000000000+201    0.2710103682E-01     0.000000000        0.1161751469E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8957149458     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.18521E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.27098E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219139596        0.1412525725    
 intlbfgs> Highest QCI image energy=    0.1852101185E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1852101185E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    528    0.1852101185E-04   -0.1000000000+201    0.2709816857E-01     0.000000000        0.4193325771E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8957116232     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.18511E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.27091E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219139604        0.1410014440    
 intlbfgs> Highest QCI image energy=    0.1851066954E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1851066954E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    529    0.1851066954E-04   -0.1000000000+201    0.2709072734E-01     0.000000000        0.5100537524E-05        15     3
 intlbfgs> Mean deviation     0.1410014440     Decreasing QCI force constant to      1.044854058    
 intlbfgs> largest atomic distance between images is     0.8957097739     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.18504E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.27086E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219139609        0.1408475989    
 intlbfgs> Highest QCI image energy=    0.1850443006E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1850443006E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    530    0.1850443006E-04   -0.1000000000+201    0.2708620039E-01     0.000000000        0.3626488194E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8955635612     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.18289E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.26932E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219139926        0.1286947782    
 intlbfgs> Highest QCI image energy=    0.1828905035E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1828905035E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    531    0.1828905035E-04   -0.1000000000+201    0.2693181150E-01     0.000000000        0.2850794873E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8957054867     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.18499E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.27082E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219139617        0.1405415880    
 intlbfgs> Highest QCI image energy=    0.1849894332E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1849894332E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    532    0.1849894332E-04   -0.1000000000+201    0.2708240011E-01     0.000000000        0.2818858458E-03        15     3
 intlbfgs> largest atomic distance between images is     0.8957071039     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.18500E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.27083E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219139614        0.1406450740    
 intlbfgs> Highest QCI image energy=    0.1850032502E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1850032502E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    533    0.1850032502E-04   -0.1000000000+201    0.2708330358E-01     0.000000000        0.3955319014E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8957073398     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.18494E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.27079E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219139616        0.1406616613    
 intlbfgs> Highest QCI image energy=    0.1849389266E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1849389266E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    534    0.1849389266E-04   -0.1000000000+201    0.2707856747E-01     0.000000000        0.4437626601E-06        15     3
 intlbfgs> Mean deviation     0.1406616613     Decreasing QCI force constant to      1.034508968    
 intlbfgs> largest atomic distance between images is     0.8957092254     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.18144E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.26820E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219139750        0.1408176951    
 intlbfgs> Highest QCI image energy=    0.1814416974E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1814416974E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    535    0.1814416974E-04   -0.1000000000+201    0.2682048849E-01     0.000000000        0.6847260906E-05        15     3
 intlbfgs> largest atomic distance between images is     0.9574560743     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind      3 atoms     11     2 value=    0.11495E-03 d,cutoff=     2.6299         2.6462     max grad=    0.18667E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.238047398         4.600321704    
 intlbfgs> Highest QCI image energy=    0.2122823257E-03 images=       1
 intlbfgs> Highest image        2 energy     0.2122823257E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    536   -0.1000000000+201    0.1149453170E-03   -0.1000000000+201    0.1866663285E-01     5.738376152            15     3
 intlbfgs> largest atomic distance between images is     0.8957711440     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.91713E-05 d,ref,cutoff=     1.4367         1.7205        0.28316     max grad=    0.19050E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219143800        0.1458170106    
 intlbfgs> Highest QCI image energy=    0.9171330796E-05 images=       1
 intlbfgs> Highest image        2 energy     0.9171330796E-05 is      0.000000000     sigma from the mean
 intlbfgs> steps:    537    0.9171330796E-05   -0.1000000000+201    0.1905042368E-01     0.000000000        0.1997923109            15     3
 intlbfgs> largest atomic distance between images is     0.8947909771     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16758E-02 d,ref,cutoff=     1.4293         1.7205        0.28316     max grad=    0.26492    
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=     1.219035265        0.4774085244E-02
 intlbfgs> Highest QCI image energy=    0.1675828437E-02 images=       1
 intlbfgs> Highest image        2 energy     0.1675828437E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    538    0.1675828437E-02   -0.1000000000+201    0.2649237921         0.000000000        0.6350893306E-02        15     3
 intlbfgs> largest atomic distance between images is     0.8957138226     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.17451E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.26302E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140019        0.1411975214    
 intlbfgs> Highest QCI image energy=    0.1745112074E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1745112074E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    539    0.1745112074E-04   -0.1000000000+201    0.2630162723E-01     0.000000000        0.6156074851E-02        15     3
 intlbfgs> Mean deviation     0.1411975214     Decreasing QCI force constant to      1.024266305    
 intlbfgs> largest atomic distance between images is     0.8957117687     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.17789E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.26556E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219139887        0.1410314875    
 intlbfgs> Highest QCI image energy=    0.1778935423E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1778935423E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    540    0.1778935423E-04   -0.1000000000+201    0.2655611044E-01     0.000000000        0.6897282261E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8957127302     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.17626E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.26433E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219139950        0.1411089465    
 intlbfgs> Highest QCI image energy=    0.1762568265E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1762568265E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    541    0.1762568265E-04   -0.1000000000+201    0.2643326951E-01     0.000000000        0.3284361123E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8957136126     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.17462E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.26310E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140015        0.1411796275    
 intlbfgs> Highest QCI image energy=    0.1746156733E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1746156733E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    542    0.1746156733E-04   -0.1000000000+201    0.2630952802E-01     0.000000000        0.3195394682E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8957135337     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.17461E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.26309E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140015        0.1411728551    
 intlbfgs> Highest QCI image energy=    0.1746068936E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1746068936E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    543    0.1746068936E-04   -0.1000000000+201    0.2630886723E-01     0.000000000        0.2102411139E-06        15     3
 intlbfgs> largest atomic distance between images is     0.8957107309     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.17453E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.26303E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140022        0.1409327893    
 intlbfgs> Highest QCI image energy=    0.1745315396E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1745315396E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    544    0.1745315396E-04   -0.1000000000+201    0.2630326409E-01     0.000000000        0.7366883840E-05        15     3
 intlbfgs> Mean deviation     0.1409327893     Decreasing QCI force constant to      1.014125055    
 intlbfgs> largest atomic distance between images is     0.8957107547     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.17456E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.26305E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140021        0.1409319871    
 intlbfgs> Highest QCI image energy=    0.1745570160E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1745570160E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    545    0.1745570160E-04   -0.1000000000+201    0.2630518361E-01     0.000000000        0.4267460728E-06        15     3
 intlbfgs> largest atomic distance between images is     0.8957107421     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.17453E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.26303E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140023        0.1409257629    
 intlbfgs> Highest QCI image energy=    0.1745312719E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1745312719E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    546    0.1745312719E-04   -0.1000000000+201    0.2630322972E-01     0.000000000        0.8396172919E-06        15     3
 intlbfgs> largest atomic distance between images is     0.8957010548     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.17112E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.26045E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140173        0.1401895811    
 intlbfgs> Highest QCI image energy=    0.1711213420E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1711213420E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    547    0.1711213420E-04   -0.1000000000+201    0.2604475003E-01     0.000000000        0.2384158735E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8957088870     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.17144E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.26068E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140150        0.1407734132    
 intlbfgs> Highest QCI image energy=    0.1714356725E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1714356725E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    548    0.1714356725E-04   -0.1000000000+201    0.2606832673E-01     0.000000000        0.1814938251E-04        15     3
 intlbfgs> largest atomic distance between images is     0.8957110813     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.17133E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.26060E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140151        0.1409547676    
 intlbfgs> Highest QCI image energy=    0.1713316722E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1713316722E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    549    0.1713316722E-04   -0.1000000000+201    0.2606031274E-01     0.000000000        0.5337757824E-05        15     3
 intlbfgs> Mean deviation     0.1409547676     Decreasing QCI force constant to      1.004084213    
 intlbfgs> largest atomic distance between images is     0.8957110310     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.17116E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.26047E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140158        0.1409578987    
 intlbfgs> Highest QCI image energy=    0.1711598401E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1711598401E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    550    0.1711598401E-04   -0.1000000000+201    0.2604721733E-01     0.000000000        0.1088273962E-05        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.8957108197     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.17098E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.26034E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140165        0.1409480977    
 intlbfgs> Highest QCI image energy=    0.1709806842E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1709806842E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    551    0.1709806842E-04   -0.1000000000+201    0.2603356293E-01     0.000000000        0.1115587407E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8957091797     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16831E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25829E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140275        0.1408741859    
 intlbfgs> Highest QCI image energy=    0.1683138387E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1683138387E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    552    0.1683138387E-04   -0.1000000000+201    0.2582931752E-01     0.000000000        0.9682871829E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8957096792     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16808E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25811E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140284        0.1409012562    
 intlbfgs> Highest QCI image energy=    0.1680783350E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1680783350E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    553    0.1680783350E-04   -0.1000000000+201    0.2581114888E-01     0.000000000        0.2046153386E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8957112047     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16782E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25791E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140293        0.1409756845    
 intlbfgs> Highest QCI image energy=    0.1678192754E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1678192754E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    554    0.1678192754E-04   -0.1000000000+201    0.2579105561E-01     0.000000000        0.7211397894E-05        15     3
 intlbfgs> Mean deviation     0.1409756845     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957115001     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16790E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25797E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140289        0.1409894965    
 intlbfgs> Highest QCI image energy=    0.1679031119E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1679031119E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    555    0.1679031119E-04   -0.1000000000+201    0.2579748751E-01     0.000000000        0.1484093717E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8957118769     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16781E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25790E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140293        0.1410079259    
 intlbfgs> Highest QCI image energy=    0.1678119636E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1678119636E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    556    0.1678119636E-04   -0.1000000000+201    0.2579043049E-01     0.000000000        0.1780086900E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8957121975     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16688E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25718E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140331        0.1410298474    
 intlbfgs> Highest QCI image energy=    0.1668769666E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1668769666E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    557    0.1668769666E-04   -0.1000000000+201    0.2571825938E-01     0.000000000        0.1781849673E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8957118092     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410134207    
 intlbfgs> Highest QCI image energy=    0.1665685227E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665685227E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    558    0.1665685227E-04   -0.1000000000+201    0.2569445216E-01     0.000000000        0.2224736141E-05        15     3
 intlbfgs> largest atomic distance between images is     0.8957117428     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410101762    
 intlbfgs> Highest QCI image energy=    0.1665657305E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665657305E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    559    0.1665657305E-04   -0.1000000000+201    0.2569424218E-01     0.000000000        0.3144381632E-06        15     3
 intlbfgs> Mean deviation     0.1410101762     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116784     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25695E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410047206    
 intlbfgs> Highest QCI image energy=    0.1665710399E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665710399E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    560    0.1665710399E-04   -0.1000000000+201    0.2569465539E-01     0.000000000        0.1829618172E-06        15     3
 intlbfgs> largest atomic distance between images is     0.8957116504     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410022113    
 intlbfgs> Highest QCI image energy=    0.1665683732E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665683732E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    561    0.1665683732E-04   -0.1000000000+201    0.2569445005E-01     0.000000000        0.8970215980E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8957116485     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019974    
 intlbfgs> Highest QCI image energy=    0.1665662032E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665662032E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    562    0.1665662032E-04   -0.1000000000+201    0.2569428220E-01     0.000000000        0.1199283695E-07        15     3
 intlbfgs> largest atomic distance between images is     0.8957116484     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019825    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    563    0.1665663459E-04   -0.1000000000+201    0.2569429323E-01     0.000000000        0.9719898989E-09        15     3
 intlbfgs> largest atomic distance between images is     0.8957116484     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019817    
 intlbfgs> Highest QCI image energy=    0.1665663465E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663465E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    564    0.1665663465E-04   -0.1000000000+201    0.2569429328E-01     0.000000000        0.4835713162E-10        15     3
 intlbfgs> Mean deviation     0.1410019817     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116463     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410018266    
 intlbfgs> Highest QCI image energy=    0.1665662805E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665662805E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    565    0.1665662805E-04   -0.1000000000+201    0.2569428824E-01     0.000000000        0.3349118081E-08        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019187    
 intlbfgs> Highest QCI image energy=    0.1665663464E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663464E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    566    0.1665663464E-04   -0.1000000000+201    0.2569429330E-01     0.000000000        0.2232423866E-08        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019186    
 intlbfgs> Highest QCI image energy=    0.1665663455E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663455E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    567    0.1665663455E-04   -0.1000000000+201    0.2569429323E-01     0.000000000        0.6208800845E-10        15     3
 intlbfgs> largest atomic distance between images is     0.8957116474     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019169    
 intlbfgs> Highest QCI image energy=    0.1665663532E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663532E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    568    0.1665663532E-04   -0.1000000000+201    0.2569429383E-01     0.000000000        0.4183667563E-10        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019186    
 intlbfgs> Highest QCI image energy=    0.1665663460E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663460E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    569    0.1665663460E-04   -0.1000000000+201    0.2569429327E-01     0.000000000        0.3707394075E-10        15     3
 intlbfgs> Mean deviation     0.1410019186     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019186    
 intlbfgs> Highest QCI image energy=    0.1665663460E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663460E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    570    0.1665663460E-04   -0.1000000000+201    0.2569429327E-01     0.000000000        0.9038967279E-12        15     3
 intlbfgs> largest atomic distance between images is     0.8957116474     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019166    
 intlbfgs> Highest QCI image energy=    0.1665663448E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663448E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    571    0.1665663448E-04   -0.1000000000+201    0.2569429318E-01     0.000000000        0.4579879493E-10        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019182    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    572    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3231403582E-10        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    573    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3664111846E-12        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    574    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.8947125974E-13        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    575    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1678945765E-12        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    576    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1174896523E-12        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    577    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1024089746E-12        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    578    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.8834824952E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    579    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1892052915E-14        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    580    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.4033250655E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    581    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1353584771E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    582    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.8940937088E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    583    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1624837949E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    584    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1476758578E-13        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    585    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.5597549350E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    586    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3567361719E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    587    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1988684267E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    588    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1737543332E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    589    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2456172810E-13        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    590    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2469446687E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    591    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1081522570E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    592    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.6225903984E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    593    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.5270034867E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    594    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1465462540E-14        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    595    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1349061627E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    596    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.6082358115E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    597    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1209408619E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    598    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.8414316800E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    599    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1722851909E-15        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 checkrep> number of active repulsions and total=      58      58
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663458E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663458E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    600    0.1665663458E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.7199865466E-12        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    601    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.7194545602E-12        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    602    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1351364153E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    603    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1217256123E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    604    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1369823928E-14        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    605    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.8521679791E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    606    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.7248773765E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    607    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2187348021E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    608    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1306997630E-15        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    609    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1714667374E-15        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    610    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1552808101E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    611    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.4250508008E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    612    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3803365268E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    613    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.7026128210E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    614    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1088313716E-13        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    615    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.5602633778E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    616    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.5404896507E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    617    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3421789904E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    618    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1126318092E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    619    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.8735100399E-15        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    620    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3091287665E-16        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    621    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2764193447E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    622    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2754419797E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    623    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3094010620E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    624    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2966693526E-16        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    625    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1497921797E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    626    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1428518557E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    627    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2099249030E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    628    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1855357073E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    629    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1428358046E-14        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    630    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1157792668E-14        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    631    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.8277074334E-16        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    632    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.9185105307E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    633    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1031970809E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    634    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.5497093555E-14        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    635    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.4152280735E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    636    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.9257525962E-16        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    637    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1094899795E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    638    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1035679361E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    639    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2217750767E-13        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    640    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2157800423E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    641    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.7300433019E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    642    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2216931467E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    643    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2176717032E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    644    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2298469741E-15        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    645    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1497972458E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    646    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1489187808E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    647    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2277455725E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    648    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.6839143133E-16        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    649    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1411214834E-13        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    650    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1374758041E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    651    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2873334096E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    652    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1242292758E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    653    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1189375975E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    654    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3985865812E-14        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    655    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3551769040E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    656    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.5435149693E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    657    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.4063416844E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    658    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2626213060E-12        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    659    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2622448155E-12        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    660    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2242439417E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    661    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1684621526E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    662    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1079685153E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    663    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.4141426388E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    664    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1411517429E-15        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    665    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3311248756E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    666    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2777702170E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    667    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.6362248428E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    668    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.6829223719E-16        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    669    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1277793327E-12        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    670    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1280044240E-12        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    671    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.5915317301E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    672    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.4981061611E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    673    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.4793056461E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    674    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1963873589E-14        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    675    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.8041793978E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    676    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1056875904E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    677    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.4889145148E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    678    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.4043677993E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    679    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3985375535E-13        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    680    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.4051060717E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    681    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3830701852E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    682    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.7902903438E-16        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    683    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2247312930E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    684    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.8916259108E-15        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    685    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2557574947E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    686    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.6065878798E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    687    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.6046024147E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    688    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1783103411E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    689    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.6734479988E-14        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    690    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.6792938600E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    691    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.4319908202E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    692    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3994372167E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    693    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.7244694651E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    694    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.5763723602E-15        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    695    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3855287771E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    696    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3765253168E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    697    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1339727537E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    698    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.8670630889E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    699    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1131940487E-14        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 checkrep> number of active repulsions and total=      58      58
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    700    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.8094961359E-15        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    701    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.5825565647E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    702    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.5242607509E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    703    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3070864338E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    704    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2380040804E-14        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    705    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2183136396E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    706    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.5786233275E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    707    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.5353021311E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    708    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.4581010625E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    709    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3883763065E-14        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    710    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2936587827E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    711    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3067005385E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    712    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2454856190E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    713    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.6943902908E-16        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    714    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.8088901093E-14        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    715    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.7647045787E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    716    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1502432367E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    717    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.5883058022E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    718    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.5828823559E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    719    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3816657197E-15        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    720    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.4109618385E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    721    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1643966987E-15        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    722    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2105407003E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    723    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.6381629577E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    724    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2127510741E-13        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    725    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3945867787E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    726    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3242313780E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    727    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1042680270E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    728    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2495181542E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    729    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1558785680E-14        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    730    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.5629110452E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    731    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2816792351E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    732    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.8647667747E-12        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    733    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.8642852654E-12        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    734    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.4280880932E-14        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    735    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3157140322E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    736    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.9092365925E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    737    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.5277339180E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    738    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.5041297606E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    739    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2681085932E-15        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    740    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.7279014043E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    741    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.7227829717E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    742    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.6677295258E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    743    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3631255522E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    744    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2715646989E-14        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    745    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2270506841E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    746    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3474524384E-15        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    747    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.8179200662E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    748    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2040327118E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    749    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2030641683E-13        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    750    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.6234177718E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    751    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3436139566E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    752    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2327339630E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    753    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1763201465E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    754    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1735429404E-13        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    755    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.5440440175E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    756    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.5100145507E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    757    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1264296068E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    758    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1163592712E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    759    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2418542005E-15        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    760    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.9679131488E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    761    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.9647987033E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    762    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.5600523244E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    763    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.7015502524E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    764    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.6910957297E-13        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    765    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.4326731764E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    766    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3611081900E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    767    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.4236261212E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    768    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3124381590E-12        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    769    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3119735451E-12        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    770    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.4364837255E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663458E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663458E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    771    0.1665663458E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.5795039103E-12        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    772    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.5784475354E-12        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    773    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3149734810E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    774    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2591271230E-14        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    775    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3848038251E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    776    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2079080883E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    777    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2335332836E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    778    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2509922017E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    779    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1847283872E-14        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    780    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1552415795E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    781    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1005469135E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    782    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.5453918003E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    783    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1987375611E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    784    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.6093370320E-15        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    785    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1117058719E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    786    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2705331367E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    787    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2049927319E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    788    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2024129408E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    789    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1109297924E-13        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    790    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1087551807E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    791    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2971830027E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    792    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2002788955E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    793    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.6998890096E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    794    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.6973312041E-13        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    795    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.7070293904E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    796    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2712878997E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    797    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2473919763E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    798    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1316508841E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    799    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.7712950750E-15        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 checkrep> number of active repulsions and total=      58      58
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    800    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3747282504E-15        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    801    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1787794949E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    802    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1723083147E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    803    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.6319317555E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    804    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.4291558685E-15        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    805    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3830125159E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    806    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2449309647E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    807    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2412427658E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    808    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2343127315E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    809    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1182219626E-14        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    810    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.6580085687E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    811    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2834188630E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    812    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2058059795E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    813    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1859947844E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    814    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1825514803E-13        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    815    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.4292669597E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    816    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1911344919E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    817    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.7409785247E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    818    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.7077824226E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    819    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1036083024E-14        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    820    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.6665737028E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    821    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2201967397E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    822    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1905536986E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    823    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.9585067027E-16        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663458E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663458E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    824    0.1665663458E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.7200239871E-13        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    825    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.7201961213E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    826    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.4972703709E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    827    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2068144346E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    828    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.4473082729E-16        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    829    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3162455399E-14        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    830    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2824005992E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    831    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2115723567E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    832    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1412964025E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    833    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.6806585253E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    834    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.5469993029E-15        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    835    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.7437181227E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    836    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.7544041661E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    837    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3504597984E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    838    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1822729446E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    839    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.8633698516E-15        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    840    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1118172388E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    841    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.4965595134E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    842    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2059959527E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    843    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1798561693E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    844    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1446275773E-15        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663458E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663458E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    845    0.1665663458E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1682113521E-12        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    846    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1687205731E-12        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    847    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1998882133E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    848    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1279397762E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    849    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.6042984597E-15        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    850    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.4332252364E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    851    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1890109283E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    852    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1839325785E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    853    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.7813981719E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    854    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3769652083E-15        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    855    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2449008530E-12        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    856    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2438968307E-12        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    857    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.6071257628E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    858    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.5541531143E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    859    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.4645487660E-15        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    860    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1244986821E-12        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    861    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1240098948E-12        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    862    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.7079125659E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    863    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1330925592E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    864    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.5999260128E-16        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    865    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.7203480998E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    866    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.6886742917E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    867    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.7449957509E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    868    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.5442528537E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    869    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3743279707E-14        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    870    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3205361478E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    871    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.5735205124E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    872    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1530945747E-12        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    873    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1523906773E-12        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    874    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1000415504E-13        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    875    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.9741551755E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    876    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2569923900E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    877    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.9653209856E-16        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    878    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2324651935E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    879    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1533681363E-14        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    880    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.5979104300E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    881    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1055113305E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    882    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.5208497171E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    883    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1179809837E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    884    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.6018735416E-15        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    885    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2421038567E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    886    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1525021367E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    887    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.5040610556E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    888    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.4559724437E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    889    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.7458534807E-15        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    890    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.8339132390E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    891    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3589556869E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    892    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2141652752E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    893    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1926780212E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    894    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.4021761574E-14        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    895    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.4020766469E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    896    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3745698651E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    897    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.6108223533E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    898    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1701245189E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    899    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2062249303E-14        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 checkrep> number of active repulsions and total=      58      58
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    900    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.6532128015E-15        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    901    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3751414777E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    902    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1461288016E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    903    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1465405059E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    904    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.4615324811E-13        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    905    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.4281369675E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    906    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.8391374143E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    907    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.8216064422E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    908    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.8664056403E-16        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    909    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3347742343E-13        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    910    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3327890055E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    911    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.5150889709E-16        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    912    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1887966916E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    913    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1375317622E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    914    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.4870092256E-15        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    915    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2744002091E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    916    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1979805015E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    917    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1940845590E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    918    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.4325205603E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    919    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2301542960E-15        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    920    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1050452014E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    921    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.4435167555E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    922    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2928363062E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    923    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2902734953E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    924    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3323394790E-14        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    925    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2331311611E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    926    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.5278284320E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    927    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.4919887796E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    928    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3513056915E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    929    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3024339318E-14        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    930    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3378109797E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    931    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1841425880E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    932    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1247469889E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    933    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.9055393677E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    934    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1026678325E-14        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    935    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.9629137867E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    936    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1188372897E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    937    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1728539254E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    938    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1282108834E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    939    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.8458422193E-15        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    940    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.8354512438E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    941    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.6358587589E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    942    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1129788466E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    943    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.6339062537E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    944    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.7893407910E-15        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    945    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.5010674041E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    946    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1740486558E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    947    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.7363550558E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    948    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.6777571998E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    949    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.5894794551E-15        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    950    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.5133185021E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    951    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.4331436809E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    952    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2799035852E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    953    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1057536447E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663458E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663458E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    954    0.1665663458E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1820996246E-12        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    955    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1817244865E-12        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    956    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1997586559E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    957    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.8291300258E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    958    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.7848338051E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    959    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.4903108044E-15        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    960    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.4493704306E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    961    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1040054343E-12        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    962    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1035262138E-12        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    963    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.4830440081E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    964    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1920489790E-15        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    965    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.9739386536E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    966    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.9696620923E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    967    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.8611765540E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    968    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.7940535161E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    969    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.9333406428E-15        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    970    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.5828220676E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    971    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1761506157E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    972    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1125391753E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    973    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1858635850E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    974    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.6858794048E-14        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    975    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.6321740538E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    976    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1000245283E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    977    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.5880333474E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    978    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.7406287878E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    979    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.6619930407E-14        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    980    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2913426007E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    981    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2758977033E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    982    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.5391338651E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    983    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2031044439E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    984    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1361395288E-12        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    985    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1357007271E-12        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    986    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3104694239E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    987    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2372240173E-12        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    988    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2367453824E-12        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    989    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.7987351459E-13        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    990    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.7672615207E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    991    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.7598012236E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    992    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.7615211141E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    993    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2784081809E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    994    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.5076087902E-14        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    995    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.4823386343E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    996    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.8071127633E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    997    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3323684640E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    998    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.8686330464E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    999    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.8915576825E-13        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 checkrep> number of active repulsions and total=      58      58
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1000    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3605050028E-13        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1001    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3281439783E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1002    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2424021869E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1003    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1692811224E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1004    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2004362979E-13        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1005    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1981115314E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1006    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.1854703166E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1007    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.5379796825E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1008    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2533657639E-13        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1009    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2552732905E-13        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1010    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.8167147430E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1011    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.5672637285E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1012    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2547324068E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1013    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2799459173E-15        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1014    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.2246319578E-14        15     3
 intlbfgs> Mean deviation     0.1410019181     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.16657E-04 d,ref,cutoff=     1.4365         1.7205        0.28316     max grad=    0.25694E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=    0.1665663459E-04 images=       1
 intlbfgs> Highest image        2 energy     0.1665663459E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1015    0.1665663459E-04   -0.1000000000+201    0.2569429326E-01     0.000000000        0.3631943235E-14        15     3
 intlbfgs> Allowing   1000 further optimization steps
 intlbfgs> extra distance before turning on constraint potential is now     0.050000
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=     6.2936     d,ref,cutoff=     1.4365         1.7205        0.13316     max grad=     247.60    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=     12.99665302     images=       1
 intlbfgs> Highest image        2 energy      12.99665302     is      0.000000000     sigma from the mean
 intlbfgs> steps:   1016     6.293643847       -0.1000000000+201     247.5972276         0.000000000        0.2478940281E-14        15     3
 intlbfgs> largest atomic distance between images is     0.8957116475     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=     6.2936     d,ref,cutoff=     1.4365         1.7205        0.13316     max grad=     247.60    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.219140344        0.1410019181    
 intlbfgs> Highest QCI image energy=     12.99665302     images=       1
 intlbfgs> Highest image        2 energy      12.99665302     is      0.000000000     sigma from the mean
 intlbfgs> steps:   1017     6.293643847       -0.1000000000+201     247.5972276         0.000000000        0.2606643991E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9110091404     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     15 atoms      3    15 value=     18.235     d,ref,cutoff=     4.6141         4.7642        0.56598E-01 max grad=     558.48    
 congrad> Highest repulsion  for image      2 ind     47 atoms     15     8 value=    0.59237E-05 d,cutoff=     5.1503         5.1576     max grad=    0.16048E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=     1.235233583         1.878515043    
 intlbfgs> Highest QCI image energy=     28.79726475     images=       1
 intlbfgs> Highest image        2 energy      28.79726475     is      0.000000000     sigma from the mean
 intlbfgs> steps:   1018     18.23480750        0.5923735249E-05     558.4761428        0.1604783194E-02     13.54858647            15     3
 intlbfgs> largest atomic distance between images is     0.9003306711     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=     3.8993     d,ref,cutoff=     1.4612         1.7205        0.13316     max grad=     62.746    
 congrad> Highest repulsion  for image      2 ind     47 atoms     15     8 value=    0.28901E-05 d,cutoff=     5.1525         5.1576     max grad=    0.11206E-02
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.224259719        0.6284276568    
 intlbfgs> Highest QCI image energy=     5.026439959     images=       1
 intlbfgs> Highest image        2 energy      5.026439959     is      0.000000000     sigma from the mean
 intlbfgs> steps:   1019     3.899274603        0.2890053111E-05     62.74576169        0.1120568205E-02    0.2290704550            15     3
 intlbfgs> Mean deviation     0.6284276568     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9037488734     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=     2.5270     d,ref,cutoff=     1.4805         1.7205        0.13316     max grad=     39.678    
 congrad> Highest repulsion  for image      2 ind     47 atoms     15     8 value=    0.13491E-03 d,cutoff=     5.1232         5.1576     max grad=    0.77120E-02
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.228659861        0.9312151741    
 intlbfgs> Highest QCI image energy=     2.853433577     images=       1
 intlbfgs> Highest image        2 energy      2.853433577     is      0.000000000     sigma from the mean
 intlbfgs> steps:   1020     2.526998499        0.1349062691E-03     39.67786229        0.7711998814E-02    0.4312331258E-01        15     3
 intlbfgs> largest atomic distance between images is     0.9047886448     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.77981     d,ref,cutoff=     1.5208         1.7205        0.13316     max grad=     18.347    
 congrad> Highest repulsion  for image      2 ind     47 atoms     15     8 value=    0.23821E-03 d,cutoff=     5.1119         5.1576     max grad=    0.10278E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.232939544         1.284637434    
 intlbfgs> Highest QCI image energy=    0.8443085584     images=       1
 intlbfgs> Highest image        2 energy     0.8443085584     is      0.000000000     sigma from the mean
 intlbfgs> steps:   1021    0.7798113946        0.2382129181E-03     18.34726567        0.1027763402E-01    0.3825740441E-01        15     3
 intlbfgs> largest atomic distance between images is     0.9048680707     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.15866     d,ref,cutoff=     1.5540         1.7205        0.13316     max grad=     6.8991    
 congrad> Highest repulsion  for image      2 ind     47 atoms     15     8 value=    0.16664E-03 d,cutoff=     5.1193         5.1576     max grad=    0.85784E-02
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.234437910         1.392022609    
 intlbfgs> Highest QCI image energy=    0.1588242961     images=       1
 intlbfgs> Highest image        2 energy     0.1588242961     is      0.000000000     sigma from the mean
 intlbfgs> steps:   1022    0.1586563916        0.1666374321E-03     6.899101451        0.8578424377E-02    0.2652423701E-01        15     3
 intlbfgs> largest atomic distance between images is     0.9063012531     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     13 atoms      3     9 value=    0.17988E-01 d,ref,cutoff=     5.0252         4.9056        0.10961     max grad=     4.0694    
 congrad> Highest repulsion  for image      2 ind     47 atoms     15     8 value=    0.26525E-03 d,cutoff=     5.1094         5.1576     max grad=    0.10850E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.238246301         1.610347725    
 intlbfgs> Highest QCI image energy=    0.4637427105E-01 images=       1
 intlbfgs> Highest image        2 energy     0.4637427105E-01 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1023    0.1798821727E-01    0.2652503027E-03     4.069381374        0.1084981705E-01    0.2555662900E-01        15     3
 intlbfgs> largest atomic distance between images is     0.9044590521     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     47 atoms     15     8 value=    0.10935E-03 d,cutoff=     5.1266         5.1576     max grad=    0.11024E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.235845676         1.544151813    
 intlbfgs> Highest QCI image energy=    0.1885184709E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1885184709E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1024   -0.1000000000+201    0.1093457384E-03   -0.1000000000+201    0.1102363235E-01    0.2604659095E-01        15     3
 intlbfgs> Mean deviation      1.544151813     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9042739142     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.28955E-06 d,ref,cutoff=     1.5873         1.7205        0.13316     max grad=    0.74231E-02
 congrad> Highest repulsion  for image      2 ind     47 atoms     15     8 value=    0.98992E-04 d,cutoff=     5.1281         5.1576     max grad=    0.10872E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.235579500         1.527881697    
 intlbfgs> Highest QCI image energy=    0.1763033682E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1763033682E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1025    0.2895547969E-06    0.9899156404E-04    0.7423143634E-02    0.1087168592E-01    0.2033394194E-02        15     3
 intlbfgs> largest atomic distance between images is     0.8995972973     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      2 atoms      1     7 value=    0.95637E-01 d,ref,cutoff=     1.7188         1.7831        0.53598E-01 max grad=     17.371    
 congrad> Highest repulsion  for image      2 ind      3 atoms     11     2 value=    0.92729E-05 d,cutoff=     2.6416         2.6462     max grad=    0.37537E-02
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226829132        0.7588851108    
 intlbfgs> Highest QCI image energy=    0.1660770394     images=       1
 intlbfgs> Highest image        2 energy     0.1660770394     is      0.000000000     sigma from the mean
 intlbfgs> steps:   1026    0.9563664230E-01    0.9272902449E-05     17.37074916        0.3753691616E-02    0.9347451136E-01        15     3
 intlbfgs> largest atomic distance between images is     0.9016330265     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.40919E-02 d,ref,cutoff=     1.5814         1.7205        0.13316     max grad=    0.91962    
 congrad> Highest repulsion  for image      2 ind      3 atoms     11     2 value=    0.55958E-04 d,cutoff=     2.6348         2.6462     max grad=    0.92559E-02
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.232285492         1.305363380    
 intlbfgs> Highest QCI image energy=    0.4154689018E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4154689018E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1027    0.4091886027E-02    0.5595822577E-04    0.9196179109        0.9255878651E-02    0.6467874905E-01        15     3
 intlbfgs> largest atomic distance between images is     0.9020712971     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.65190E-03 d,ref,cutoff=     1.5850         1.7205        0.13316     max grad=    0.35769    
 congrad> Highest repulsion  for image      2 ind      3 atoms     11     2 value=    0.66278E-04 d,cutoff=     2.6338         2.6462     max grad=    0.10080E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.232864600         1.350880784    
 intlbfgs> Highest QCI image energy=    0.7313932143E-03 images=       1
 intlbfgs> Highest image        2 energy     0.7313932143E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1028    0.6518956939E-03    0.6627761902E-04    0.3576939029        0.1007986390E-01    0.4911884040E-02        15     3
 intlbfgs> largest atomic distance between images is     0.9001264906     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.30358E-03 d,ref,cutoff=     1.5857         1.7205        0.13316     max grad=    0.24216    
 congrad> Highest repulsion  for image      2 ind      3 atoms     11     2 value=    0.64621E-04 d,cutoff=     2.6340         2.6462     max grad=    0.99536E-02
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.230910289         1.181400627    
 intlbfgs> Highest QCI image energy=    0.3681996316E-03 images=       1
 intlbfgs> Highest image        2 energy     0.3681996316E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1029    0.3035789056E-03    0.6462072603E-04    0.2421613889        0.9953640363E-02    0.2387916487E-01        15     3
 intlbfgs> Mean deviation      1.181400627     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9050940034     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.39925E-04 d,ref,cutoff=     1.5867         1.7205        0.13316     max grad=    0.86308E-01
 congrad> Highest repulsion  for image      2 ind      3 atoms     11     2 value=    0.44291E-04 d,cutoff=     2.6361         2.6462     max grad=    0.82361E-02
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.227499357        0.5290650242    
 intlbfgs> Highest QCI image energy=    0.8421617756E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8421617756E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1030    0.3992535477E-04    0.4429082279E-04    0.8630825828E-01    0.8236121639E-02    0.8955838435E-01        15     3
 intlbfgs> largest atomic distance between images is     0.9051030766     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.36763E-04 d,ref,cutoff=     1.5868         1.7205        0.13316     max grad=    0.82400E-01
 congrad> Highest repulsion  for image      2 ind      3 atoms     11     2 value=    0.10888E-04 d,cutoff=     2.6412         2.6462     max grad=    0.40754E-02
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.227278855        0.5290395509    
 intlbfgs> Highest QCI image energy=    0.4765071490E-04 images=       1
 intlbfgs> Highest image        2 energy     0.4765071490E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1031    0.3676293006E-04    0.1088778484E-04    0.8240015262E-01    0.4075410561E-02    0.1010596787E-01        15     3
 intlbfgs> largest atomic distance between images is     0.9042695116     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      2 atoms      1     7 value=     3.9697     d,ref,cutoff=     1.6784         1.7831        0.53598E-01 max grad=     183.61    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226278482        0.5952086702    
 intlbfgs> Highest QCI image energy=     4.302652248     images=       1
 intlbfgs> Highest image        2 energy      4.302652248     is      0.000000000     sigma from the mean
 intlbfgs> steps:   1032     3.969658727       -0.1000000000+201     183.6095649         0.000000000        0.4495037292E-01        15     3
 intlbfgs> largest atomic distance between images is     0.9046531491     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.31828E-04 d,ref,cutoff=     1.5868         1.7205        0.13316     max grad=    0.75856E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.227063359        0.5731495898    
 intlbfgs> Highest QCI image energy=    0.3182788439E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3182788439E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1033    0.3182788439E-04   -0.1000000000+201    0.7585591788E-01     0.000000000        0.3853853165E-01        15     3
 intlbfgs> largest atomic distance between images is     0.9045040772     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.34543E-04 d,ref,cutoff=     1.5868         1.7205        0.13316     max grad=    0.78969E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.227057255        0.5871844283    
 intlbfgs> Highest QCI image energy=    0.3454284813E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3454284813E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1034    0.3454284813E-04   -0.1000000000+201    0.7896898918E-01     0.000000000        0.2278422936E-02        15     3
 intlbfgs> Mean deviation     0.5871844283     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9046241688     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.45062E-01 d,ref,cutoff=     1.5687         1.7205        0.13316     max grad=     3.2587    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.225873934        0.4075500865    
 intlbfgs> Highest QCI image energy=    0.4506238530E-01 images=       1
 intlbfgs> Highest image        2 energy     0.4506238530E-01 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1035    0.4506238530E-01   -0.1000000000+201     3.258651103         0.000000000        0.2344814907E-01        15     3
 intlbfgs> largest atomic distance between images is     0.9044496008     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.71621E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11389    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.227037200        0.5903436996    
 intlbfgs> Highest QCI image energy=    0.7162088480E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7162088480E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1036    0.7162088480E-04   -0.1000000000+201    0.1138856605         0.000000000        0.2386033534E-01        15     3
 intlbfgs> largest atomic distance between images is     0.9044445954     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79597E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.12009    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.227033221        0.5907719943    
 intlbfgs> Highest QCI image energy=    0.7959670268E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7959670268E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1037    0.7959670268E-04   -0.1000000000+201    0.1200936650         0.000000000        0.8361350411E-04        15     3
 intlbfgs> largest atomic distance between images is     0.9044365064     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.10974E-03 d,ref,cutoff=     1.5864         1.7205        0.13316     max grad=    0.14114    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.227011103        0.5929054551    
 intlbfgs> Highest QCI image energy=    0.1097379696E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1097379696E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1038    0.1097379696E-03   -0.1000000000+201    0.1411415189         0.000000000        0.4383081814E-03        15     3
 intlbfgs> largest atomic distance between images is     0.9044332305     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      2 atoms      1     7 value=    0.11349E-02 d,ref,cutoff=     1.7282         1.7831        0.53598E-01 max grad=     1.6268    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226885501        0.6062287966    
 intlbfgs> Highest QCI image energy=    0.1405584770E-02 images=       1
 intlbfgs> Highest image        2 energy     0.1405584770E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1039    0.1134856389E-02   -0.1000000000+201     1.626789687         0.000000000        0.2915934343E-02        15     3
 intlbfgs> Mean deviation     0.6062287966     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9044370229     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.10094E-03 d,ref,cutoff=     1.5864         1.7205        0.13316     max grad=    0.13532    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.227011136        0.5940312386    
 intlbfgs> Highest QCI image energy=    0.1009445373E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1009445373E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1040    0.1009445373E-03   -0.1000000000+201    0.1353210273         0.000000000        0.2794472930E-02        15     3
 intlbfgs> largest atomic distance between images is     0.9044418891     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.96920E-04 d,ref,cutoff=     1.5864         1.7205        0.13316     max grad=    0.13258    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.227009832        0.5944050761    
 intlbfgs> Highest QCI image energy=    0.9691956775E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9691956775E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1041    0.9691956775E-04   -0.1000000000+201    0.1325751159         0.000000000        0.8370059162E-04        15     3
 intlbfgs> largest atomic distance between images is     0.9049168145     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      2 atoms      1     7 value=    0.78876E-01 d,ref,cutoff=     1.7197         1.7831        0.53598E-01 max grad=     15.664    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226836838        0.6343811677    
 intlbfgs> Highest QCI image energy=    0.7887623206E-01 images=       1
 intlbfgs> Highest image        2 energy     0.7887623206E-01 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1042    0.7887623206E-01   -0.1000000000+201     15.66439876         0.000000000        0.9255623394E-02        15     3
 intlbfgs> largest atomic distance between images is     0.9044456294     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.92396E-04 d,ref,cutoff=     1.5864         1.7205        0.13316     max grad=    0.12942    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.227010326        0.5946244689    
 intlbfgs> Highest QCI image energy=    0.9239553124E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9239553124E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1043    0.9239553124E-04   -0.1000000000+201    0.1294221150         0.000000000        0.9218151336E-02        15     3
 intlbfgs> largest atomic distance between images is     0.9044489228     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.88968E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.12698    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.227010453        0.5948325259    
 intlbfgs> Highest QCI image energy=    0.8896765839E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8896765839E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1044    0.8896765839E-04   -0.1000000000+201    0.1269818238         0.000000000        0.3811966178E-04        15     3
 intlbfgs> Mean deviation     0.5948325259     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9046410979     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      2 atoms      1     7 value=    0.14940E-02 d,ref,cutoff=     1.7281         1.7831        0.53598E-01 max grad=     1.8729    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226988275        0.6076954454    
 intlbfgs> Highest QCI image energy=    0.1496522900E-02 images=       1
 intlbfgs> Highest image        2 energy     0.1496522900E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1045    0.1494012844E-02   -0.1000000000+201     1.872897503         0.000000000        0.2562914202E-02        15     3
 intlbfgs> largest atomic distance between images is     0.9044567970     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.82900E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.12255    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.227010161        0.5953407454    
 intlbfgs> Highest QCI image energy=    0.8290014015E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8290014015E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1046    0.8290014015E-04   -0.1000000000+201    0.1225451118         0.000000000        0.2474968135E-02        15     3
 intlbfgs> largest atomic distance between images is     0.9044635440     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.78847E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11949    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.227009276        0.5957922547    
 intlbfgs> Highest QCI image energy=    0.7884712526E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7884712526E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1047    0.7884712526E-04   -0.1000000000+201    0.1194910972         0.000000000        0.8238091306E-04        15     3
 intlbfgs> largest atomic distance between images is     0.9049557486     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      2 atoms      1     7 value=    0.30621E-01 d,ref,cutoff=     1.7232         1.7831        0.53598E-01 max grad=     9.2221    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226897090        0.6303287522    
 intlbfgs> Highest QCI image energy=    0.3062105556E-01 images=       1
 intlbfgs> Highest image        2 energy     0.3062105556E-01 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1048    0.3062105556E-01   -0.1000000000+201     9.222100537         0.000000000        0.6757631910E-02        15     3
 intlbfgs> largest atomic distance between images is     0.9044672398     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.77789E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11868    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.227008328        0.5960497741    
 intlbfgs> Highest QCI image energy=    0.7778852601E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7778852601E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1049    0.7778852601E-04   -0.1000000000+201    0.1186800284         0.000000000        0.6711106111E-02        15     3
 intlbfgs> Mean deviation     0.5960497741     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9044707702     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.76985E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11806    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.227007294        0.5962989262    
 intlbfgs> Highest QCI image energy=    0.7698503018E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7698503018E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1050    0.7698503018E-04   -0.1000000000+201    0.1180605041         0.000000000        0.4607095625E-04        15     3
 intlbfgs> largest atomic distance between images is     0.9063912626     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      2 atoms      1     7 value=    0.81956     d,ref,cutoff=     1.7022         1.7831        0.53598E-01 max grad=     64.521    
 congrad> Highest repulsion  for image      2 ind      3 atoms     11     2 value=    0.57050E-05 d,cutoff=     2.6426         2.6462     max grad=    0.29549E-02
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226565527        0.7351623024    
 intlbfgs> Highest QCI image energy=    0.8420264978     images=       1
 intlbfgs> Highest image        2 energy     0.8420264978     is      0.000000000     sigma from the mean
 intlbfgs> steps:   1051    0.8195556320        0.5704959978E-05     64.52074687        0.2954939121E-02    0.2682558101E-01        15     3
 intlbfgs> largest atomic distance between images is     0.9044725309     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.77337E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11833    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.227006439        0.5964312530    
 intlbfgs> Highest QCI image energy=    0.7733686767E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7733686767E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1052    0.7733686767E-04   -0.1000000000+201    0.1183309097         0.000000000        0.2680056563E-01        15     3
 intlbfgs> largest atomic distance between images is     0.9044743333     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.77599E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11853    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.227005623        0.5965652807    
 intlbfgs> Highest QCI image energy=    0.7759917072E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7759917072E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1053    0.7759917072E-04   -0.1000000000+201    0.1185319200         0.000000000        0.2515635692E-04        15     3
 intlbfgs> largest atomic distance between images is     0.9074266821     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      2 atoms      1     7 value=     1.6807     d,ref,cutoff=     1.6929         1.7831        0.53598E-01 max grad=     103.03    
 congrad> Highest repulsion  for image      2 ind      3 atoms     11     2 value=    0.39446E-04 d,cutoff=     2.6367         2.6462     max grad=    0.77969E-02
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226557225        0.8056198528    
 intlbfgs> Highest QCI image energy=     1.793756554     images=       1
 intlbfgs> Highest image        2 energy      1.793756554     is      0.000000000     sigma from the mean
 intlbfgs> steps:   1054     1.680692027        0.3944618157E-04     103.0288480        0.7796885624E-02    0.3782309053E-01        15     3
 intlbfgs> Mean deviation     0.8056198528     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9044756311     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.78859E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11950    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.227004533        0.5966747652    
 intlbfgs> Highest QCI image energy=    0.7885948124E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7885948124E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1055    0.7885948124E-04   -0.1000000000+201    0.1194958468         0.000000000        0.3780130765E-01        15     3
 intlbfgs> largest atomic distance between images is     0.9044771492     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79558E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.12003    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.227003677        0.5967916606    
 intlbfgs> Highest QCI image energy=    0.7955788622E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7955788622E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1056    0.7955788622E-04   -0.1000000000+201    0.1200264304         0.000000000        0.2181599298E-04        15     3
 intlbfgs> largest atomic distance between images is     0.9055038613     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      2 atoms      1     7 value=    0.97938E-01 d,ref,cutoff=     1.7187         1.7831        0.53598E-01 max grad=     17.738    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226653471        0.6713197839    
 intlbfgs> Highest QCI image energy=    0.9830650315E-01 images=       1
 intlbfgs> Highest image        2 energy     0.9830650315E-01 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1057    0.9793800934E-01   -0.1000000000+201     17.73767579         0.000000000        0.1307663684E-01        15     3
 intlbfgs> largest atomic distance between images is     0.9044814787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.80098E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.12043    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.227002222        0.5970996676    
 intlbfgs> Highest QCI image energy=    0.8009799607E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8009799607E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1058    0.8009799607E-04   -0.1000000000+201    0.1204340170         0.000000000        0.1302629403E-01        15     3
 intlbfgs> largest atomic distance between images is     0.9044858466     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.80480E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.12072    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.227000842        0.5974081850    
 intlbfgs> Highest QCI image energy=    0.8047959644E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8047959644E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1059    0.8047959644E-04   -0.1000000000+201    0.1207206737         0.000000000        0.5016141837E-04        15     3
 intlbfgs> Mean deviation     0.5974081850     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9076349150     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      2 atoms      1     7 value=    0.87438     d,ref,cutoff=     1.7014         1.7831        0.53598E-01 max grad=     67.267    
 congrad> Highest repulsion  for image      2 ind      3 atoms     11     2 value=    0.49159E-04 d,cutoff=     2.6356         2.6462     max grad=    0.87093E-02
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226692389        0.8113176935    
 intlbfgs> Highest QCI image energy=    0.9001677327     images=       1
 intlbfgs> Highest image        2 energy     0.9001677327     is      0.000000000     sigma from the mean
 intlbfgs> steps:   1060    0.8743804622        0.4915861327E-04     67.26724544        0.8709258036E-02    0.3406488362E-01        15     3
 intlbfgs> largest atomic distance between images is     0.9044888304     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.81875E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.12177    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226999510        0.5976310244    
 intlbfgs> Highest QCI image energy=    0.8187479940E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8187479940E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1061    0.8187479940E-04   -0.1000000000+201    0.1217678364         0.000000000        0.3402878376E-01        15     3
 intlbfgs> largest atomic distance between images is     0.9044919220     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.82581E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.12229    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226998468        0.5978521419    
 intlbfgs> Highest QCI image energy=    0.8258091514E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8258091514E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1062    0.8258091514E-04   -0.1000000000+201    0.1222938518         0.000000000        0.3505982021E-04        15     3
 intlbfgs> largest atomic distance between images is     0.9064815932     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      2 atoms      1     7 value=    0.17018     d,ref,cutoff=     1.7157         1.7831        0.53598E-01 max grad=     24.500    
 congrad> Highest repulsion  for image      2 ind      3 atoms     11     2 value=    0.75515E-05 d,cutoff=     2.6421         2.6462     max grad=    0.34006E-02
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226685920        0.7342047521    
 intlbfgs> Highest QCI image energy=    0.1703781221     images=       1
 intlbfgs> Highest image        2 energy     0.1703781221     is      0.000000000     sigma from the mean
 intlbfgs> steps:   1063    0.1701845405        0.7551468341E-05     24.50028371        0.3400587824E-02    0.2071311347E-01        15     3
 intlbfgs> largest atomic distance between images is     0.9044984615     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.81753E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.12167    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226997570        0.5982857253    
 intlbfgs> Highest QCI image energy=    0.8175307199E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8175307199E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1064    0.8175307199E-04   -0.1000000000+201    0.1216731906         0.000000000        0.2065211940E-01        15     3
 intlbfgs> Mean deviation     0.5982857253     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9045048288     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.81252E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.12130    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226996552        0.5987117045    
 intlbfgs> Highest QCI image energy=    0.8125198809E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8125198809E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1065    0.8125198809E-04   -0.1000000000+201    0.1212951407         0.000000000        0.6090023911E-04        15     3
 intlbfgs> largest atomic distance between images is     0.9072024785     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      2 atoms      1     7 value=    0.27221     d,ref,cutoff=     1.7124         1.7831        0.53598E-01 max grad=     32.464    
 congrad> Highest repulsion  for image      2 ind      3 atoms     11     2 value=    0.29230E-04 d,cutoff=     2.6380         2.6462     max grad=    0.67061E-02
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226692852        0.7809505836    
 intlbfgs> Highest QCI image energy=    0.2724527852     images=       1
 intlbfgs> Highest image        2 energy     0.2724527852     is      0.000000000     sigma from the mean
 intlbfgs> steps:   1066    0.2722081052        0.2922980950E-04     32.46446174        0.6706101145E-02    0.2700846123E-01        15     3
 intlbfgs> largest atomic distance between images is     0.9045130982     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79090E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11966    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226996231        0.5992425268    
 intlbfgs> Highest QCI image energy=    0.7908990646E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7908990646E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1067    0.7908990646E-04   -0.1000000000+201    0.1196577292         0.000000000        0.2693919744E-01        15     3
 intlbfgs> largest atomic distance between images is     0.9045206474     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.77924E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11876    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226995531        0.5997366175    
 intlbfgs> Highest QCI image energy=    0.7792372023E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7792372023E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1068    0.7792372023E-04   -0.1000000000+201    0.1187643095         0.000000000        0.6730062597E-04        15     3
 intlbfgs> largest atomic distance between images is     0.9064785636     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      2 atoms      1     7 value=    0.68196E-01 d,ref,cutoff=     1.7204         1.7831        0.53598E-01 max grad=     14.422    
 congrad> Highest repulsion  for image      2 ind      3 atoms     11     2 value=    0.72884E-05 d,cutoff=     2.6421         2.6462     max grad=    0.33406E-02
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226827402        0.7300966392    
 intlbfgs> Highest QCI image energy=    0.6824026687E-01 images=       1
 intlbfgs> Highest image        2 energy     0.6824026687E-01 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1069    0.6819581263E-01    0.7288400393E-05     14.42206328        0.3340638898E-02    0.1839308998E-01        15     3
 intlbfgs> Mean deviation     0.7300966392     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9045311050     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.78433E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11915    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226993733        0.6004427954    
 intlbfgs> Highest QCI image energy=    0.7843313415E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7843313415E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1070    0.7843313415E-04   -0.1000000000+201    0.1191504871         0.000000000        0.1829364709E-01        15     3
 intlbfgs> largest atomic distance between images is     0.9045415298     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.78733E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11938    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226992046        0.6011441688    
 intlbfgs> Highest QCI image energy=    0.7873306884E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7873306884E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1071    0.7873306884E-04   -0.1000000000+201    0.1193757499         0.000000000        0.9845109401E-04        15     3
 intlbfgs> largest atomic distance between images is     0.9072014761     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      2 atoms      1     7 value=    0.21338     d,ref,cutoff=     1.7142         1.7831        0.53598E-01 max grad=     28.033    
 congrad> Highest repulsion  for image      2 ind      3 atoms     11     2 value=    0.25584E-04 d,cutoff=     2.6385         2.6462     max grad=    0.62719E-02
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226917659        0.7722354290    
 intlbfgs> Highest QCI image energy=    0.2134285067     images=       1
 intlbfgs> Highest image        2 energy     0.2134285067     is      0.000000000     sigma from the mean
 intlbfgs> steps:   1072    0.2133842809        0.2558394681E-04     28.03291726        0.6271884728E-02    0.2383434175E-01        15     3
 intlbfgs> largest atomic distance between images is     0.9045893490     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.10310E-03 d,ref,cutoff=     1.5864         1.7205        0.13316     max grad=    0.13670    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226979725        0.6046281516    
 intlbfgs> Highest QCI image energy=    0.1031023621E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1031023621E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1073    0.1031023621E-03   -0.1000000000+201    0.1367044497         0.000000000        0.2336382177E-01        15     3
 intlbfgs> largest atomic distance between images is     0.9046020944     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.10145E-03 d,ref,cutoff=     1.5864         1.7205        0.13316     max grad=    0.13559    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226978965        0.6054596518    
 intlbfgs> Highest QCI image energy=    0.1014504993E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1014504993E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1074    0.1014504993E-03   -0.1000000000+201    0.1355923036         0.000000000        0.1103234783E-03        15     3
 intlbfgs> Mean deviation     0.6054596518     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9065685427     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      2 atoms      1     7 value=    0.24101E-01 d,ref,cutoff=     1.7239         1.7831        0.53598E-01 max grad=     8.0913    
 congrad> Highest repulsion  for image      2 ind      3 atoms     11     2 value=    0.97133E-05 d,cutoff=     2.6415         2.6462     max grad=    0.38579E-02
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226863077        0.7361000945    
 intlbfgs> Highest QCI image energy=    0.2428953910E-01 images=       1
 intlbfgs> Highest image        2 energy     0.2428953910E-01 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1075    0.2410094143E-01    0.9713324926E-05     8.091342656        0.3857941078E-02    0.1802177728E-01        15     3
 intlbfgs> largest atomic distance between images is     0.9046284064     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.87580E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.12591    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226982074        0.6070535051    
 intlbfgs> Highest QCI image energy=    0.8757979063E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8757979063E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1076    0.8757979063E-04   -0.1000000000+201    0.1259119522         0.000000000        0.1783616559E-01        15     3
 intlbfgs> largest atomic distance between images is     0.9046503016     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.82621E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.12227    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226982040        0.6084491179    
 intlbfgs> Highest QCI image energy=    0.8262061230E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8262061230E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1077    0.8262061230E-04   -0.1000000000+201    0.1222650205         0.000000000        0.1791653434E-03        15     3
 intlbfgs> largest atomic distance between images is     0.9054433421     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      2 atoms      1     7 value=    0.15831E-02 d,ref,cutoff=     1.7280         1.7831        0.53598E-01 max grad=     1.9296    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226956043        0.6600162199    
 intlbfgs> Highest QCI image energy=    0.1606868026E-02 images=       1
 intlbfgs> Highest image        2 energy     0.1606868026E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1078    0.1583058744E-02   -0.1000000000+201     1.929574640         0.000000000        0.6833366075E-02        15     3
 intlbfgs> largest atomic distance between images is     0.9046862329     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.80085E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.12035    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226980075        0.6107951446    
 intlbfgs> Highest QCI image energy=    0.8008530442E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8008530442E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1079    0.8008530442E-04   -0.1000000000+201    0.1203502797         0.000000000        0.6523053630E-02        15     3
 intlbfgs> Mean deviation     0.6107951446     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9047189809     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.78516E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11915    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226978007        0.6129412896    
 intlbfgs> Highest QCI image energy=    0.7851626859E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7851626859E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1080    0.7851626859E-04   -0.1000000000+201    0.1191468734         0.000000000        0.2858099257E-03        15     3
 intlbfgs> largest atomic distance between images is     0.9062261741     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      2 atoms      1     7 value=    0.22497E-01 d,ref,cutoff=     1.7241         1.7831        0.53598E-01 max grad=     7.7931    
 congrad> Highest repulsion  for image      2 ind      3 atoms     11     2 value=    0.30193E-05 d,cutoff=     2.6436         2.6462     max grad=    0.21483E-02
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226797691        0.7140702723    
 intlbfgs> Highest QCI image energy=    0.2287616699E-01 images=       1
 intlbfgs> Highest image        2 energy     0.2287616699E-01 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1081    0.2249676854E-01    0.3019288120E-05     7.793067516        0.2148297028E-02    0.1434110728E-01        15     3
 intlbfgs> largest atomic distance between images is     0.9047826271     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.67487E-04 d,ref,cutoff=     1.5866         1.7205        0.13316     max grad=    0.11039    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226980017        0.6170045316    
 intlbfgs> Highest QCI image energy=    0.6748701640E-04 images=       1
 intlbfgs> Highest image        2 energy     0.6748701640E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1082    0.6748701640E-04   -0.1000000000+201    0.1103929542         0.000000000        0.1383938745E-01        15     3
 intlbfgs> largest atomic distance between images is     0.9048147547     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.65999E-04 d,ref,cutoff=     1.5866         1.7205        0.13316     max grad=    0.10915    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226978783        0.6191029852    
 intlbfgs> Highest QCI image energy=    0.6599926685E-04 images=       1
 intlbfgs> Highest image        2 energy     0.6599926685E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1083    0.6599926685E-04   -0.1000000000+201    0.1091522858         0.000000000        0.2776885670E-03        15     3
 intlbfgs> largest atomic distance between images is     0.9060090755     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      2 atoms      1     7 value=    0.21442E-02 d,ref,cutoff=     1.7278         1.7831        0.53598E-01 max grad=     2.2557    
 congrad> Highest repulsion  for image      2 ind      3 atoms     11     2 value=    0.92254E-06 d,cutoff=     2.6448         2.6462     max grad=    0.11867E-02
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226867375        0.6995214484    
 intlbfgs> Highest QCI image energy=    0.2535879955E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2535879955E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1084    0.2144249723E-02    0.9225449809E-06     2.255675027        0.1186690724E-02    0.1128562853E-01        15     3
 intlbfgs> Mean deviation     0.6995214484     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9048501793     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.83549E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.12288    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226968977        0.6216311571    
 intlbfgs> Highest QCI image energy=    0.8354887236E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8354887236E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1085    0.8354887236E-04   -0.1000000000+201    0.1228816091         0.000000000        0.1090294529E-01        15     3
 intlbfgs> largest atomic distance between images is     0.9048995627     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.73484E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11518    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226970775        0.6247649550    
 intlbfgs> Highest QCI image energy=    0.7348447507E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7348447507E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1086    0.7348447507E-04   -0.1000000000+201    0.1151819443         0.000000000        0.3980645094E-03        15     3
 intlbfgs> largest atomic distance between images is     0.9055264661     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      2 atoms      1     7 value=    0.20690E-03 d,ref,cutoff=     1.7290         1.7831        0.53598E-01 max grad=    0.68563    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226955922        0.6657821015    
 intlbfgs> Highest QCI image energy=    0.2757209163E-03 images=       1
 intlbfgs> Highest image        2 energy     0.2757209163E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1087    0.2069046837E-03   -0.1000000000+201    0.6856287206         0.000000000        0.5471674737E-02        15     3
 intlbfgs> largest atomic distance between images is     0.9049678228     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79412E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11974    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226965572        0.6293055568    
 intlbfgs> Highest QCI image energy=    0.7941234620E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7941234620E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1088    0.7941234620E-04   -0.1000000000+201    0.1197410665         0.000000000        0.4852791657E-02        15     3
 intlbfgs> largest atomic distance between images is     0.9050191203     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.80107E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.12025    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226963310        0.6326744740    
 intlbfgs> Highest QCI image energy=    0.8010662277E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8010662277E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1089    0.8010662277E-04   -0.1000000000+201    0.1202484093         0.000000000        0.4509431561E-03        15     3
 intlbfgs> Mean deviation     0.6326744740     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9051556033     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      2 atoms      1     7 value=    0.37748     d,ref,cutoff=     1.7098         1.7831        0.53598E-01 max grad=     39.630    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226407766        0.6457452283    
 intlbfgs> Highest QCI image energy=    0.3867057186     images=       1
 intlbfgs> Highest image        2 energy     0.3867057186     is      0.000000000     sigma from the mean
 intlbfgs> steps:   1090    0.3774823065       -0.1000000000+201     39.62987968         0.000000000        0.1416718690E-01        15     3
 intlbfgs> largest atomic distance between images is     0.9050614487     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.80073E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.12021    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226962421        0.6354449557    
 intlbfgs> Highest QCI image energy=    0.8007281420E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8007281420E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1091    0.8007281420E-04   -0.1000000000+201    0.1202079180         0.000000000        0.1411887245E-01        15     3
 intlbfgs> largest atomic distance between images is     0.9050629561     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.80448E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.12049    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226961633        0.6355467459    
 intlbfgs> Highest QCI image energy=    0.8044836804E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8044836804E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1092    0.8044836804E-04   -0.1000000000+201    0.1204907309         0.000000000        0.2201934881E-04        15     3
 intlbfgs> largest atomic distance between images is     0.9072158456     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      2 atoms      1     7 value=     2.6056     d,ref,cutoff=     1.6860         1.7831        0.53598E-01 max grad=     138.06    
 congrad> Highest repulsion  for image      2 ind      3 atoms     11     2 value=    0.15327E-04 d,cutoff=     2.6403         2.6462     max grad=    0.48494E-02
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226353142        0.7736784541    
 intlbfgs> Highest QCI image energy=     2.820909867     images=       1
 intlbfgs> Highest image        2 energy      2.820909867     is      0.000000000     sigma from the mean
 intlbfgs> steps:   1093     2.605581926        0.1532681458E-04     138.0605261        0.4849428834E-02    0.3437054641E-01        15     3
 intlbfgs> largest atomic distance between images is     0.9050626752     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.78986E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11938    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226961850        0.6355099454    
 intlbfgs> Highest QCI image energy=    0.7898644319E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7898644319E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1094    0.7898644319E-04   -0.1000000000+201    0.1193844789         0.000000000        0.3436502057E-01        15     3
 intlbfgs> Mean deviation     0.6355099454     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9050628165     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.78226E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11880    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226961784        0.6355086452    
 intlbfgs> Highest QCI image energy=    0.7822602855E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7822602855E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1095    0.7822602855E-04   -0.1000000000+201    0.1188049917         0.000000000        0.1185417584E-04        15     3
 intlbfgs> largest atomic distance between images is     0.9050982789     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      2 atoms      1     7 value=    0.28915E-01 d,ref,cutoff=     1.7234         1.7831        0.53598E-01 max grad=     8.9366    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226889004        0.6351392072    
 intlbfgs> Highest QCI image energy=    0.2891504390E-01 images=       1
 intlbfgs> Highest image        2 energy     0.2891504390E-01 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1096    0.2891504390E-01   -0.1000000000+201     8.936571717         0.000000000        0.4517174110E-02        15     3
 intlbfgs> largest atomic distance between images is     0.9050629844     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.77797E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11848    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226961067        0.6355073682    
 intlbfgs> Highest QCI image energy=    0.7789714641E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7789714641E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1097    0.7779710503E-04   -0.1000000000+201    0.1184770050         0.000000000        0.4490783798E-02        15     3
 intlbfgs> largest atomic distance between images is     0.9050630832     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.77687E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11839    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226960472        0.6355065321    
 intlbfgs> Highest QCI image energy=    0.7870030022E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7870030022E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1098    0.7768721229E-04   -0.1000000000+201    0.1183928989         0.000000000        0.1888232857E-04        15     3
 intlbfgs> largest atomic distance between images is     0.9050630828     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.78175E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11877    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226960149        0.6355078274    
 intlbfgs> Highest QCI image energy=    0.7946711558E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7946711558E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1099    0.7817532420E-04   -0.1000000000+201    0.1187665312         0.000000000        0.4157133541E-05        15     3
 intlbfgs> Mean deviation     0.6355078274     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9050630909     for atom     10 and images      2     3 total images=     1
 checkrep> number of active repulsions and total=      58      58
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.78688E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11916    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226959906        0.6355090814    
 intlbfgs> Highest QCI image energy=    0.8005234046E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8005234046E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1100    0.7868825793E-04   -0.1000000000+201    0.1191579201         0.000000000        0.2936643981E-05        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.9050632965     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.80596E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.12060    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226959075        0.6355204053    
 intlbfgs> Highest QCI image energy=    0.8205714993E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8205714993E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1101    0.8059627905E-04   -0.1000000000+201    0.1206028595         0.000000000        0.1219214751E-04        15     3
 intlbfgs> largest atomic distance between images is     0.9050643158     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.82097E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.12173    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226958435        0.6355638351    
 intlbfgs> Highest QCI image energy=    0.8357518336E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8357518336E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1102    0.8209700277E-04   -0.1000000000+201    0.1217274846         0.000000000        0.1755096950E-04        15     3
 intlbfgs> largest atomic distance between images is     0.9050707762     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.85640E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.12434    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226956856        0.6358315091    
 intlbfgs> Highest QCI image energy=    0.8721645932E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8721645932E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1103    0.8564021140E-04   -0.1000000000+201    0.1243429083         0.000000000        0.8171098724E-04        15     3
 intlbfgs> largest atomic distance between images is     0.9050890649     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.90822E-04 d,ref,cutoff=     1.5864         1.7205        0.13316     max grad=    0.12807    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226954579        0.6365815870    
 intlbfgs> Highest QCI image energy=    0.9224813163E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9224813163E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1104    0.9082186808E-04   -0.1000000000+201    0.1280729220         0.000000000        0.2087316562E-03        15     3
 intlbfgs> Mean deviation     0.6365815870     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9051425833     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.96059E-04 d,ref,cutoff=     1.5864         1.7205        0.13316     max grad=    0.13174    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226951144        0.6387709176    
 intlbfgs> Highest QCI image energy=    0.1000205229E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1000205229E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1105    0.9605887530E-04   -0.1000000000+201    0.1317356337         0.000000000        0.5688504585E-03        15     3
 intlbfgs> largest atomic distance between images is     0.9051638307     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.95649E-04 d,ref,cutoff=     1.5864         1.7205        0.13316     max grad=    0.13145    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226951684        0.6396315710    
 intlbfgs> Highest QCI image energy=    0.9745830083E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9745830083E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1106    0.9564922855E-04   -0.1000000000+201    0.1314514363         0.000000000        0.2164269532E-03        15     3
 intlbfgs> largest atomic distance between images is     0.9051963040     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.89491E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.12712    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226954102        0.6409450064    
 intlbfgs> Highest QCI image energy=    0.9046679584E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9046679584E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1107    0.8949061281E-04   -0.1000000000+201    0.1271192826         0.000000000        0.3087892060E-03        15     3
 intlbfgs> largest atomic distance between images is     0.9052328334     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.81899E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.12157    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226956911        0.6424245728    
 intlbfgs> Highest QCI image energy=    0.8286424880E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8286424880E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1108    0.8189885320E-04   -0.1000000000+201    0.1215715072         0.000000000        0.3434870591E-03        15     3
 intlbfgs> largest atomic distance between images is     0.9052354563     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79176E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11952    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957851        0.6425309410    
 intlbfgs> Highest QCI image energy=    0.8049819504E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8049819504E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1109    0.7917563027E-04   -0.1000000000+201    0.1195205254         0.000000000        0.1874081511E-04        15     3
 intlbfgs> Mean deviation     0.6425309410     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052366620     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79455E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11973    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957756        0.6425798656    
 intlbfgs> Highest QCI image energy=    0.8072111932E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8072111932E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1110    0.7945491710E-04   -0.1000000000+201    0.1197323910         0.000000000        0.1370382328E-04        15     3
 intlbfgs> largest atomic distance between images is     0.9052374432     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79622E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11986    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957686        0.6426116184    
 intlbfgs> Highest QCI image energy=    0.8088633226E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8088633226E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1111    0.7962243155E-04   -0.1000000000+201    0.1198592916         0.000000000        0.8884581996E-05        15     3
 intlbfgs> largest atomic distance between images is     0.9052383895     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79853E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.12003    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957572        0.6426500602    
 intlbfgs> Highest QCI image energy=    0.8115822261E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8115822261E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1112    0.7985277023E-04   -0.1000000000+201    0.1200336003         0.000000000        0.1142605793E-04        15     3
 intlbfgs> largest atomic distance between images is     0.9052389886     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79818E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.12001    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957587        0.6426742949    
 intlbfgs> Highest QCI image energy=    0.8111599697E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8111599697E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1113    0.7981751809E-04   -0.1000000000+201    0.1200069221         0.000000000        0.6230945587E-05        15     3
 intlbfgs> largest atomic distance between images is     0.9052395983     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957619        0.6426988333    
 intlbfgs> Highest QCI image energy=    0.8103253399E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8103253399E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1114    0.7973687853E-04   -0.1000000000+201    0.1199459174         0.000000000        0.6694771233E-05        15     3
 intlbfgs> Mean deviation     0.6426988333     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052408526     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79932E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.12009    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957552        0.6427487673    
 intlbfgs> Highest QCI image energy=    0.8118630250E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8118630250E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1115    0.7993209650E-04   -0.1000000000+201    0.1200937077         0.000000000        0.1861315270E-04        15     3
 intlbfgs> largest atomic distance between images is     0.9052409180     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79763E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11997    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957616        0.6427508220    
 intlbfgs> Highest QCI image energy=    0.8102752599E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102752599E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1116    0.7976337039E-04   -0.1000000000+201    0.1199662145         0.000000000        0.4461861233E-05        15     3
 intlbfgs> largest atomic distance between images is     0.9052395899     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79211E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11955    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957834        0.6426927752    
 intlbfgs> Highest QCI image energy=    0.8049866671E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8049866671E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1117    0.7921063818E-04   -0.1000000000+201    0.1195481231         0.000000000        0.2760867148E-04        15     3
 intlbfgs> largest atomic distance between images is     0.9052388072     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79320E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11963    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957756        0.6426545670    
 intlbfgs> Highest QCI image energy=    0.8069497053E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8069497053E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1118    0.7931962869E-04   -0.1000000000+201    0.1196322292         0.000000000        0.4888678905E-04        15     3
 intlbfgs> largest atomic distance between images is     0.9052362047     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79129E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11949    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957860        0.6425457519    
 intlbfgs> Highest QCI image energy=    0.8045750879E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8045750879E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1119    0.7912947831E-04   -0.1000000000+201    0.1194885652         0.000000000        0.2593326913E-04        15     3
 intlbfgs> Mean deviation     0.6425457519     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052329462     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79397E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11969    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957773        0.6424111731    
 intlbfgs> Highest QCI image energy=    0.8069551912E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8069551912E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1120    0.7939737150E-04   -0.1000000000+201    0.1196924953         0.000000000        0.2821632998E-04        15     3
 intlbfgs> largest atomic distance between images is     0.9052322509     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79717E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11994    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957650        0.6423818286    
 intlbfgs> Highest QCI image energy=    0.8100345050E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8100345050E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1121    0.7971735744E-04   -0.1000000000+201    0.1199351699         0.000000000        0.7023954438E-05        15     3
 intlbfgs> largest atomic distance between images is     0.9052319642     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79734E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957641        0.6423703314    
 intlbfgs> Highest QCI image energy=    0.8102666849E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102666849E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1122    0.7973385829E-04   -0.1000000000+201    0.1199476133         0.000000000        0.4407567859E-05        15     3
 intlbfgs> largest atomic distance between images is     0.9052321330     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957640        0.6423771646    
 intlbfgs> Highest QCI image energy=    0.8102886837E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102886837E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1123    0.7973687852E-04   -0.1000000000+201    0.1199498828         0.000000000        0.1637527948E-05        15     3
 intlbfgs> largest atomic distance between images is     0.9052320958     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79743E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957635        0.6423748412    
 intlbfgs> Highest QCI image energy=    0.8104030370E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8104030370E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1124    0.7974271477E-04   -0.1000000000+201    0.1199543581         0.000000000        0.1992280847E-05        15     3
 intlbfgs> Mean deviation     0.6423748412     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052321299     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79738E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957639        0.6423768736    
 intlbfgs> Highest QCI image energy=    0.8103016204E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8103016204E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1125    0.7973750771E-04   -0.1000000000+201    0.1199503661         0.000000000        0.1745213255E-05        15     3
 intlbfgs> largest atomic distance between images is     0.9052321263     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79738E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957639        0.6423766652    
 intlbfgs> Highest QCI image energy=    0.8103039091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8103039091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1126    0.7973775613E-04   -0.1000000000+201    0.1199505547         0.000000000        0.6069370052E-08        15     3
 intlbfgs> largest atomic distance between images is     0.9052318301     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79753E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11996    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957635        0.6423589736    
 intlbfgs> Highest QCI image energy=    0.8104474873E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8104474873E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1127    0.7975275544E-04   -0.1000000000+201    0.1199619614         0.000000000        0.4700983207E-06        15     3
 intlbfgs> largest atomic distance between images is     0.9052314940     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79757E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11997    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957634        0.6423388353    
 intlbfgs> Highest QCI image energy=    0.8104906396E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8104906396E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1128    0.7975734917E-04   -0.1000000000+201    0.1199655006         0.000000000        0.5464258043E-06        15     3
 intlbfgs> largest atomic distance between images is     0.9052302775     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79753E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11996    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957642        0.6422657934    
 intlbfgs> Highest QCI image energy=    0.8104352938E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8104352938E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1129    0.7975342303E-04   -0.1000000000+201    0.1199627860         0.000000000        0.2007928238E-05        15     3
 intlbfgs> Mean deviation     0.6422657934     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052289767     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79768E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11997    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957638        0.6421883095    
 intlbfgs> Highest QCI image energy=    0.8106836745E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8106836745E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1130    0.7976821151E-04   -0.1000000000+201    0.1199742415         0.000000000        0.2121162176E-05        15     3
 intlbfgs> largest atomic distance between images is     0.9052299407     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79748E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11996    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957646        0.6422456418    
 intlbfgs> Highest QCI image energy=    0.8104002395E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8104002395E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1131    0.7974776703E-04   -0.1000000000+201    0.1199585769         0.000000000        0.1557640713E-05        15     3
 intlbfgs> largest atomic distance between images is     0.9052299584     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79745E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11996    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957647        0.6422466612    
 intlbfgs> Highest QCI image energy=    0.8103731973E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8103731973E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1132    0.7974508591E-04   -0.1000000000+201    0.1199565443         0.000000000        0.3161602470E-07        15     3
 intlbfgs> largest atomic distance between images is     0.9052299590     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79736E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957650        0.6422465442    
 intlbfgs> Highest QCI image energy=    0.8102880983E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102880983E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1133    0.7973623945E-04   -0.1000000000+201    0.1199498495         0.000000000        0.4629685275E-07        15     3
 intlbfgs> largest atomic distance between images is     0.9052299672     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79736E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957650        0.6422470101    
 intlbfgs> Highest QCI image energy=    0.8102847613E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102847613E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1134    0.7973588004E-04   -0.1000000000+201    0.1199495758         0.000000000        0.1788683558E-07        15     3
 intlbfgs> Mean deviation     0.6422470101     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052300751     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79733E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422530017    
 intlbfgs> Highest QCI image energy=    0.8102543315E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102543315E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1135    0.7973260830E-04   -0.1000000000+201    0.1199470764         0.000000000        0.2829817537E-06        15     3
 intlbfgs> largest atomic distance between images is     0.9052301944     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79731E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422595743    
 intlbfgs> Highest QCI image energy=    0.8102319958E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102319958E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1136    0.7973077835E-04   -0.1000000000+201    0.1199456655         0.000000000        0.3349240068E-06        15     3
 intlbfgs> largest atomic distance between images is     0.9052303731     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957648        0.6422694037    
 intlbfgs> Highest QCI image energy=    0.8103039711E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8103039711E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1137    0.7973666487E-04   -0.1000000000+201    0.1199500808         0.000000000        0.5397835369E-06        15     3
 intlbfgs> largest atomic distance between images is     0.9052302807     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79736E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957649        0.6422642515    
 intlbfgs> Highest QCI image energy=    0.8102864039E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102864039E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1138    0.7973593024E-04   -0.1000000000+201    0.1199495449         0.000000000        0.2468805444E-06        15     3
 intlbfgs> largest atomic distance between images is     0.9052302665     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957648        0.6422634382    
 intlbfgs> Highest QCI image energy=    0.8102982698E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102982698E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1139    0.7973729030E-04   -0.1000000000+201    0.1199505772         0.000000000        0.2770646340E-07        15     3
 intlbfgs> Mean deviation     0.6422634382     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052302586     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79738E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957648        0.6422629701    
 intlbfgs> Highest QCI image energy=    0.8103080452E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8103080452E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1140    0.7973833050E-04   -0.1000000000+201    0.1199513659         0.000000000        0.1237245039E-07        15     3
 intlbfgs> largest atomic distance between images is     0.9052302369     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79739E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957648        0.6422616995    
 intlbfgs> Highest QCI image energy=    0.8103164014E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8103164014E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1141    0.7973920264E-04   -0.1000000000+201    0.1199520305         0.000000000        0.3894844144E-07        15     3
 intlbfgs> largest atomic distance between images is     0.9052301748     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79741E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957647        0.6422580028    
 intlbfgs> Highest QCI image energy=    0.8103311359E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8103311359E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1142    0.7974074572E-04   -0.1000000000+201    0.1199532109         0.000000000        0.1019906978E-06        15     3
 intlbfgs> largest atomic distance between images is     0.9052300436     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79742E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957647        0.6422501461    
 intlbfgs> Highest QCI image energy=    0.8103455389E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8103455389E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1143    0.7974212476E-04   -0.1000000000+201    0.1199542814         0.000000000        0.2122460638E-06        15     3
 intlbfgs> largest atomic distance between images is     0.9052297287     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79736E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957652        0.6422311380    
 intlbfgs> Highest QCI image energy=    0.8102616668E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102616668E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1144    0.7973591099E-04   -0.1000000000+201    0.1199496436         0.000000000        0.5122065861E-06        15     3
 intlbfgs> Mean deviation     0.6422311380     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052298542     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79740E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957649        0.6422387041    
 intlbfgs> Highest QCI image energy=    0.8103252849E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8103252849E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1145    0.7974013954E-04   -0.1000000000+201    0.1199528178         0.000000000        0.2105112002E-06        15     3
 intlbfgs> largest atomic distance between images is     0.9052298464     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79739E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957650        0.6422382010    
 intlbfgs> Highest QCI image energy=    0.8103140211E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8103140211E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1146    0.7973886858E-04   -0.1000000000+201    0.1199518576         0.000000000        0.1439385143E-07        15     3
 intlbfgs> largest atomic distance between images is     0.9052298282     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422370599    
 intlbfgs> Highest QCI image energy=    0.8102928745E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102928745E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1147    0.7973663722E-04   -0.1000000000+201    0.1199501726         0.000000000        0.3111728054E-07        15     3
 intlbfgs> largest atomic distance between images is     0.9052298273     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79736E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422369816    
 intlbfgs> Highest QCI image energy=    0.8102908568E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102908568E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1148    0.7973641314E-04   -0.1000000000+201    0.1199500032         0.000000000        0.6646917405E-08        15     3
 intlbfgs> largest atomic distance between images is     0.9052298199     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79734E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957652        0.6422360974    
 intlbfgs> Highest QCI image energy=    0.8102672351E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102672351E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1149    0.7973381102E-04   -0.1000000000+201    0.1199480349         0.000000000        0.1484592360E-06        15     3
 intlbfgs> Mean deviation     0.6422360974     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052298237     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79732E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957653        0.6422357503    
 intlbfgs> Highest QCI image energy=    0.8102472712E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102472712E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1150    0.7973189566E-04   -0.1000000000+201    0.1199465838         0.000000000        0.2049247163E-06        15     3
 intlbfgs> largest atomic distance between images is     0.9052299159     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79742E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957647        0.6422395789    
 intlbfgs> Highest QCI image energy=    0.8103692657E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8103692657E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1151    0.7974160937E-04   -0.1000000000+201    0.1199539132         0.000000000        0.7135739536E-06        15     3
 intlbfgs> largest atomic distance between images is     0.9052298515     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79734E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957652        0.6422366612    
 intlbfgs> Highest QCI image energy=    0.8102668738E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102668738E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1152    0.7973384707E-04   -0.1000000000+201    0.1199480537         0.000000000        0.4159645144E-06        15     3
 intlbfgs> largest atomic distance between images is     0.9052298574     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79735E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422369765    
 intlbfgs> Highest QCI image energy=    0.8102783616E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102783616E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1153    0.7973514931E-04   -0.1000000000+201    0.1199490379         0.000000000        0.2324453399E-07        15     3
 intlbfgs> largest atomic distance between images is     0.9052298643     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957650        0.6422373357    
 intlbfgs> Highest QCI image energy=    0.8102941769E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102941769E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1154    0.7973684332E-04   -0.1000000000+201    0.1199503184         0.000000000        0.3200011773E-07        15     3
 intlbfgs> Mean deviation     0.6422373357     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052298625     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957650        0.6422372516    
 intlbfgs> Highest QCI image energy=    0.8102957366E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102957366E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1155    0.7973699620E-04   -0.1000000000+201    0.1199504345         0.000000000        0.9263377660E-08        15     3
 intlbfgs> largest atomic distance between images is     0.9052298522     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957650        0.6422367242    
 intlbfgs> Highest QCI image energy=    0.8103004435E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8103004435E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1156    0.7973743225E-04   -0.1000000000+201    0.1199507667         0.000000000        0.4025684514E-07        15     3
 intlbfgs> largest atomic distance between images is     0.9052298378     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957650        0.6422359690    
 intlbfgs> Highest QCI image energy=    0.8102978780E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102978780E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1157    0.7973731496E-04   -0.1000000000+201    0.1199506811         0.000000000        0.5336232549E-07        15     3
 intlbfgs> largest atomic distance between images is     0.9052298404     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957650        0.6422360910    
 intlbfgs> Highest QCI image energy=    0.8103001579E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8103001579E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1158    0.7973744056E-04   -0.1000000000+201    0.1199507755         0.000000000        0.1595565542E-07        15     3
 intlbfgs> largest atomic distance between images is     0.9052298392     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957650        0.6422359989    
 intlbfgs> Highest QCI image energy=    0.8102995271E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102995271E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1159    0.7973734205E-04   -0.1000000000+201    0.1199507012         0.000000000        0.5322083146E-08        15     3
 intlbfgs> Mean deviation     0.6422359989     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052298311     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422354702    
 intlbfgs> Highest QCI image energy=    0.8102960466E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102960466E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1160    0.7973691901E-04   -0.1000000000+201    0.1199503827         0.000000000        0.1658526141E-07        15     3
 intlbfgs> largest atomic distance between images is     0.9052298189     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79736E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422346867    
 intlbfgs> Highest QCI image energy=    0.8102921234E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102921234E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1161    0.7973648680E-04   -0.1000000000+201    0.1199500581         0.000000000        0.2237019749E-07        15     3
 intlbfgs> largest atomic distance between images is     0.9052297873     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79736E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422326127    
 intlbfgs> Highest QCI image energy=    0.8102878539E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102878539E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1162    0.7973602184E-04   -0.1000000000+201    0.1199497126         0.000000000        0.6666883388E-07        15     3
 intlbfgs> largest atomic distance between images is     0.9052297465     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79736E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422298483    
 intlbfgs> Highest QCI image energy=    0.8102896728E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102896728E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1163    0.7973632198E-04   -0.1000000000+201    0.1199499478         0.000000000        0.1129750767E-06        15     3
 intlbfgs> largest atomic distance between images is     0.9052297388     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422293339    
 intlbfgs> Highest QCI image energy=    0.8102965218E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102965218E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1164    0.7973700615E-04   -0.1000000000+201    0.1199504671         0.000000000        0.2062280715E-07        15     3
 intlbfgs> Mean deviation     0.6422293339     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052297337     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422290986    
 intlbfgs> Highest QCI image energy=    0.8102977068E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102977068E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1165    0.7973745271E-04   -0.1000000000+201    0.1199508062         0.000000000        0.2990727309E-07        15     3
 intlbfgs> largest atomic distance between images is     0.9052297320     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422289586    
 intlbfgs> Highest QCI image energy=    0.8102990793E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102990793E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1166    0.7973736437E-04   -0.1000000000+201    0.1199507396         0.000000000        0.1335625569E-07        15     3
 intlbfgs> largest atomic distance between images is     0.9052297334     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422290705    
 intlbfgs> Highest QCI image energy=    0.8102999242E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102999242E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1167    0.7973742180E-04   -0.1000000000+201    0.1199507828         0.000000000        0.8356206105E-08        15     3
 intlbfgs> largest atomic distance between images is     0.9052297353     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79738E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422292421    
 intlbfgs> Highest QCI image energy=    0.8103018254E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8103018254E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1168    0.7973759195E-04   -0.1000000000+201    0.1199509113         0.000000000        0.2082434146E-07        15     3
 intlbfgs> largest atomic distance between images is     0.9052297333     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79738E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422291702    
 intlbfgs> Highest QCI image energy=    0.8103013063E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8103013063E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1169    0.7973754967E-04   -0.1000000000+201    0.1199508798         0.000000000        0.1864288203E-07        15     3
 intlbfgs> Mean deviation     0.6422291702     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052297252     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422287361    
 intlbfgs> Highest QCI image energy=    0.8102997909E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102997909E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1170    0.7973741841E-04   -0.1000000000+201    0.1199507822         0.000000000        0.2777999926E-07        15     3
 intlbfgs> largest atomic distance between images is     0.9052297062     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422276143    
 intlbfgs> Highest QCI image energy=    0.8102980022E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102980022E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1171    0.7973715710E-04   -0.1000000000+201    0.1199505884         0.000000000        0.3478676801E-07        15     3
 intlbfgs> largest atomic distance between images is     0.9052296963     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422269865    
 intlbfgs> Highest QCI image energy=    0.8102965075E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102965075E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1172    0.7973706068E-04   -0.1000000000+201    0.1199505175         0.000000000        0.1659166721E-07        15     3
 intlbfgs> largest atomic distance between images is     0.9052296861     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422263095    
 intlbfgs> Highest QCI image energy=    0.8102962445E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102962445E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1173    0.7973705456E-04   -0.1000000000+201    0.1199505149         0.000000000        0.2242287294E-07        15     3
 intlbfgs> largest atomic distance between images is     0.9052296775     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257740    
 intlbfgs> Highest QCI image energy=    0.8102995749E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102995749E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1174    0.7973738534E-04   -0.1000000000+201    0.1199507670         0.000000000        0.1391150656E-07        15     3
 intlbfgs> Mean deviation     0.6422257740     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296775     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257640    
 intlbfgs> Highest QCI image energy=    0.8102998682E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998682E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1175    0.7973740819E-04   -0.1000000000+201    0.1199507843         0.000000000        0.1711131313E-08        15     3
 intlbfgs> largest atomic distance between images is     0.9052296775     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257628    
 intlbfgs> Highest QCI image energy=    0.8102998810E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998810E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1176    0.7973740637E-04   -0.1000000000+201    0.1199507829         0.000000000        0.6838456069E-09        15     3
 intlbfgs> largest atomic distance between images is     0.9052296775     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257627    
 intlbfgs> Highest QCI image energy=    0.8102998766E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998766E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1177    0.7973740527E-04   -0.1000000000+201    0.1199507821         0.000000000        0.1787251562E-09        15     3
 intlbfgs> largest atomic distance between images is     0.9052296775     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257592    
 intlbfgs> Highest QCI image energy=    0.8102998439E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998439E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1178    0.7973740023E-04   -0.1000000000+201    0.1199507783         0.000000000        0.7365534848E-09        15     3
 intlbfgs> largest atomic distance between images is     0.9052296775     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257523    
 intlbfgs> Highest QCI image energy=    0.8102997521E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102997521E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1179    0.7973738956E-04   -0.1000000000+201    0.1199507702         0.000000000        0.1072087090E-08        15     3
 intlbfgs> Mean deviation     0.6422257523     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296774     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257368    
 intlbfgs> Highest QCI image energy=    0.8102996063E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102996063E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1180    0.7973737365E-04   -0.1000000000+201    0.1199507582         0.000000000        0.1824024444E-08        15     3
 intlbfgs> largest atomic distance between images is     0.9052296772     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257042    
 intlbfgs> Highest QCI image energy=    0.8102995564E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102995564E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1181    0.7973736956E-04   -0.1000000000+201    0.1199507552         0.000000000        0.3540657597E-08        15     3
 intlbfgs> largest atomic distance between images is     0.9052296759     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422255722    
 intlbfgs> Highest QCI image energy=    0.8102999070E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102999070E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1182    0.7973733308E-04   -0.1000000000+201    0.1199507282         0.000000000        0.1203467189E-07        15     3
 intlbfgs> largest atomic distance between images is     0.9052296768     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422256575    
 intlbfgs> Highest QCI image energy=    0.8102996748E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102996748E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1183    0.7973737875E-04   -0.1000000000+201    0.1199507624         0.000000000        0.8614836652E-08        15     3
 intlbfgs> largest atomic distance between images is     0.9052296767     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422256504    
 intlbfgs> Highest QCI image energy=    0.8102997633E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102997633E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1184    0.7973738937E-04   -0.1000000000+201    0.1199507704         0.000000000        0.1056729873E-08        15     3
 intlbfgs> Mean deviation     0.6422256504     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296760     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422255932    
 intlbfgs> Highest QCI image energy=    0.8103001051E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8103001051E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1185    0.7973742918E-04   -0.1000000000+201    0.1199508009         0.000000000        0.8648098650E-08        15     3
 intlbfgs> largest atomic distance between images is     0.9052296759     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422255812    
 intlbfgs> Highest QCI image energy=    0.8102995154E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102995154E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1186    0.7973737123E-04   -0.1000000000+201    0.1199507571         0.000000000        0.1413760703E-08        15     3
 intlbfgs> largest atomic distance between images is     0.9052296760     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422255857    
 intlbfgs> Highest QCI image energy=    0.8102998218E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998218E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1187    0.7973740096E-04   -0.1000000000+201    0.1199507795         0.000000000        0.4442947502E-09        15     3
 intlbfgs> largest atomic distance between images is     0.9052296760     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422255856    
 intlbfgs> Highest QCI image energy=    0.8102998287E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998287E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1188    0.7973740092E-04   -0.1000000000+201    0.1199507795         0.000000000        0.9543974557E-10        15     3
 intlbfgs> largest atomic distance between images is     0.9052296760     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422255862    
 intlbfgs> Highest QCI image energy=    0.8102998331E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998331E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1189    0.7973740146E-04   -0.1000000000+201    0.1199507799         0.000000000        0.3152804934E-10        15     3
 intlbfgs> Mean deviation     0.6422255862     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296761     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422255949    
 intlbfgs> Highest QCI image energy=    0.8102998710E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998710E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1190    0.7973740618E-04   -0.1000000000+201    0.1199507835         0.000000000        0.3309509089E-09        15     3
 intlbfgs> largest atomic distance between images is     0.9052296764     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422256116    
 intlbfgs> Highest QCI image energy=    0.8102999048E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102999048E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1191    0.7973741045E-04   -0.1000000000+201    0.1199507866         0.000000000        0.4853573747E-09        15     3
 intlbfgs> largest atomic distance between images is     0.9052296770     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422256523    
 intlbfgs> Highest QCI image energy=    0.8102999473E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102999473E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1192    0.7973741561E-04   -0.1000000000+201    0.1199507904         0.000000000        0.1085041873E-08        15     3
 intlbfgs> largest atomic distance between images is     0.9052296779     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257071    
 intlbfgs> Highest QCI image energy=    0.8102999231E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102999231E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1193    0.7973741287E-04   -0.1000000000+201    0.1199507882         0.000000000        0.1443368102E-08        15     3
 intlbfgs> largest atomic distance between images is     0.9052296784     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257372    
 intlbfgs> Highest QCI image energy=    0.8102995826E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102995826E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1194    0.7973737956E-04   -0.1000000000+201    0.1199507628         0.000000000        0.8284134786E-09        15     3
 intlbfgs> Mean deviation     0.6422257372     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296785     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257500    
 intlbfgs> Highest QCI image energy=    0.8102997786E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102997786E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1195    0.7973739271E-04   -0.1000000000+201    0.1199507728         0.000000000        0.5008080567E-09        15     3
 intlbfgs> largest atomic distance between images is     0.9052296783     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257354    
 intlbfgs> Highest QCI image energy=    0.8102997654E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102997654E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1196    0.7973739519E-04   -0.1000000000+201    0.1199507747         0.000000000        0.4017437785E-09        15     3
 intlbfgs> largest atomic distance between images is     0.9052296783     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257362    
 intlbfgs> Highest QCI image energy=    0.8102997681E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102997681E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1197    0.7973739550E-04   -0.1000000000+201    0.1199507749         0.000000000        0.2350560551E-10        15     3
 intlbfgs> largest atomic distance between images is     0.9052296786     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257519    
 intlbfgs> Highest QCI image energy=    0.8102997814E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102997814E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1198    0.7973739712E-04   -0.1000000000+201    0.1199507761         0.000000000        0.4895569447E-09        15     3
 intlbfgs> largest atomic distance between images is     0.9052296786     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257513    
 intlbfgs> Highest QCI image energy=    0.8102997890E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102997890E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1199    0.7973739775E-04   -0.1000000000+201    0.1199507766         0.000000000        0.2624062145E-09        15     3
 intlbfgs> Mean deviation     0.6422257513     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296784     for atom     10 and images      2     3 total images=     1
 checkrep> number of active repulsions and total=      58      58
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257380    
 intlbfgs> Highest QCI image energy=    0.8102998322E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998322E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1200    0.7973740162E-04   -0.1000000000+201    0.1199507796         0.000000000        0.6556478324E-09        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.9052296783     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257314    
 intlbfgs> Highest QCI image energy=    0.8102997697E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102997697E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1201    0.7973739669E-04   -0.1000000000+201    0.1199507758         0.000000000        0.2802081662E-09        15     3
 intlbfgs> largest atomic distance between images is     0.9052296784     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257362    
 intlbfgs> Highest QCI image energy=    0.8102998147E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998147E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1202    0.7973740004E-04   -0.1000000000+201    0.1199507784         0.000000000        0.2249019719E-09        15     3
 intlbfgs> largest atomic distance between images is     0.9052296784     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257359    
 intlbfgs> Highest QCI image energy=    0.8102998115E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998115E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1203    0.7973739969E-04   -0.1000000000+201    0.1199507781         0.000000000        0.7630337674E-11        15     3
 intlbfgs> largest atomic distance between images is     0.9052296784     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257349    
 intlbfgs> Highest QCI image energy=    0.8102998023E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998023E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1204    0.7973739869E-04   -0.1000000000+201    0.1199507773         0.000000000        0.2955158562E-10        15     3
 intlbfgs> Mean deviation     0.6422257349     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296783     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257341    
 intlbfgs> Highest QCI image energy=    0.8102997975E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102997975E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1205    0.7973739817E-04   -0.1000000000+201    0.1199507770         0.000000000        0.2995144681E-10        15     3
 intlbfgs> largest atomic distance between images is     0.9052296783     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257314    
 intlbfgs> Highest QCI image energy=    0.8102997885E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102997885E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1206    0.7973739721E-04   -0.1000000000+201    0.1199507762         0.000000000        0.1170448829E-09        15     3
 intlbfgs> largest atomic distance between images is     0.9052296783     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257286    
 intlbfgs> Highest QCI image energy=    0.8102997998E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102997998E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1207    0.7973739815E-04   -0.1000000000+201    0.1199507770         0.000000000        0.1459653856E-09        15     3
 intlbfgs> largest atomic distance between images is     0.9052296782     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257225    
 intlbfgs> Highest QCI image energy=    0.8102997910E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102997910E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1208    0.7973739794E-04   -0.1000000000+201    0.1199507768         0.000000000        0.2842057495E-09        15     3
 intlbfgs> largest atomic distance between images is     0.9052296782     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257255    
 intlbfgs> Highest QCI image energy=    0.8102998133E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998133E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1209    0.7973739983E-04   -0.1000000000+201    0.1199507782         0.000000000        0.1148099740E-09        15     3
 intlbfgs> Mean deviation     0.6422257255     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296782     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257266    
 intlbfgs> Highest QCI image energy=    0.8102998228E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998228E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1210    0.7973740075E-04   -0.1000000000+201    0.1199507789         0.000000000        0.3342730772E-10        15     3
 intlbfgs> largest atomic distance between images is     0.9052296783     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257298    
 intlbfgs> Highest QCI image energy=    0.8102998364E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998364E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1211    0.7973740190E-04   -0.1000000000+201    0.1199507798         0.000000000        0.8865555891E-10        15     3
 intlbfgs> largest atomic distance between images is     0.9052296784     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257362    
 intlbfgs> Highest QCI image energy=    0.8102998527E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998527E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1212    0.7973740336E-04   -0.1000000000+201    0.1199507809         0.000000000        0.1823706072E-09        15     3
 intlbfgs> largest atomic distance between images is     0.9052296786     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257474    
 intlbfgs> Highest QCI image energy=    0.8102998589E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998589E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1213    0.7973740397E-04   -0.1000000000+201    0.1199507813         0.000000000        0.3316660784E-09        15     3
 intlbfgs> largest atomic distance between images is     0.9052296788     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257576    
 intlbfgs> Highest QCI image energy=    0.8102995785E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102995785E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1214    0.7973736932E-04   -0.1000000000+201    0.1199507550         0.000000000        0.7137577770E-09        15     3
 intlbfgs> Mean deviation     0.6422257576     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296788     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257561    
 intlbfgs> Highest QCI image energy=    0.8102998316E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998316E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1215    0.7973740137E-04   -0.1000000000+201    0.1199507793         0.000000000        0.5038406094E-09        15     3
 intlbfgs> largest atomic distance between images is     0.9052296788     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257561    
 intlbfgs> Highest QCI image energy=    0.8102998147E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998147E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1216    0.7973739985E-04   -0.1000000000+201    0.1199507781         0.000000000        0.2717131004E-10        15     3
 intlbfgs> largest atomic distance between images is     0.9052296788     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257557    
 intlbfgs> Highest QCI image energy=    0.8102997963E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102997963E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1217    0.7973739815E-04   -0.1000000000+201    0.1199507769         0.000000000        0.3553875793E-10        15     3
 intlbfgs> largest atomic distance between images is     0.9052296788     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257556    
 intlbfgs> Highest QCI image energy=    0.8102997942E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102997942E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1218    0.7973739796E-04   -0.1000000000+201    0.1199507767         0.000000000        0.1448903793E-10        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257549    
 intlbfgs> Highest QCI image energy=    0.8102997888E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102997888E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1219    0.7973739752E-04   -0.1000000000+201    0.1199507764         0.000000000        0.1387091846E-09        15     3
 intlbfgs> Mean deviation     0.6422257549     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257544    
 intlbfgs> Highest QCI image energy=    0.8102997962E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102997962E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1220    0.7973739821E-04   -0.1000000000+201    0.1199507769         0.000000000        0.9292677956E-10        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257543    
 intlbfgs> Highest QCI image energy=    0.8102998156E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998156E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1221    0.7973740027E-04   -0.1000000000+201    0.1199507785         0.000000000        0.2707948772E-10        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257543    
 intlbfgs> Highest QCI image energy=    0.8102998126E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998126E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1222    0.7973739970E-04   -0.1000000000+201    0.1199507780         0.000000000        0.7302110257E-11        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257543    
 intlbfgs> Highest QCI image energy=    0.8102998096E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998096E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1223    0.7973739946E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9777081800E-11        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257543    
 intlbfgs> Highest QCI image energy=    0.8102998095E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998095E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1224    0.7973739946E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4984203167E-12        15     3
 intlbfgs> Mean deviation     0.6422257543     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257541    
 intlbfgs> Highest QCI image energy=    0.8102998072E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998072E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1225    0.7973739929E-04   -0.1000000000+201    0.1199507777         0.000000000        0.2171295249E-10        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257537    
 intlbfgs> Highest QCI image energy=    0.8102998057E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998057E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1226    0.7973739919E-04   -0.1000000000+201    0.1199507777         0.000000000        0.3002083104E-10        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257525    
 intlbfgs> Highest QCI image energy=    0.8102998059E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998059E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1227    0.7973739924E-04   -0.1000000000+201    0.1199507777         0.000000000        0.6268708716E-10        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257513    
 intlbfgs> Highest QCI image energy=    0.8102997976E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102997976E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1228    0.7973739823E-04   -0.1000000000+201    0.1199507769         0.000000000        0.8190975717E-10        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257512    
 intlbfgs> Highest QCI image energy=    0.8102998061E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998061E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1229    0.7973739917E-04   -0.1000000000+201    0.1199507776         0.000000000        0.2222011269E-10        15     3
 intlbfgs> Mean deviation     0.6422257512     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257511    
 intlbfgs> Highest QCI image energy=    0.8102998117E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998117E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1230    0.7973739972E-04   -0.1000000000+201    0.1199507781         0.000000000        0.1447786287E-10        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257508    
 intlbfgs> Highest QCI image energy=    0.8102998150E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998150E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1231    0.7973740006E-04   -0.1000000000+201    0.1199507783         0.000000000        0.2053413394E-10        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257507    
 intlbfgs> Highest QCI image energy=    0.8102998178E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998178E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1232    0.7973740026E-04   -0.1000000000+201    0.1199507785         0.000000000        0.4608529696E-10        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257505    
 intlbfgs> Highest QCI image energy=    0.8102998156E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998156E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1233    0.7973740008E-04   -0.1000000000+201    0.1199507783         0.000000000        0.1431443877E-10        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257501    
 intlbfgs> Highest QCI image energy=    0.8102998100E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998100E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1234    0.7973739954E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1661824711E-10        15     3
 intlbfgs> Mean deviation     0.6422257501     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257498    
 intlbfgs> Highest QCI image energy=    0.8102998077E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998077E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1235    0.7973739929E-04   -0.1000000000+201    0.1199507777         0.000000000        0.1486819885E-10        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257496    
 intlbfgs> Highest QCI image energy=    0.8102998076E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998076E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1236    0.7973739927E-04   -0.1000000000+201    0.1199507777         0.000000000        0.9424058351E-11        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257494    
 intlbfgs> Highest QCI image energy=    0.8102998082E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998082E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1237    0.7973739933E-04   -0.1000000000+201    0.1199507778         0.000000000        0.8512828291E-11        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257493    
 intlbfgs> Highest QCI image energy=    0.8102998104E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998104E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1238    0.7973739952E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4598039098E-11        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257493    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1239    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4461762388E-11        15     3
 intlbfgs> Mean deviation     0.6422257493     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257493    
 intlbfgs> Highest QCI image energy=    0.8102998093E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998093E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1240    0.7973739944E-04   -0.1000000000+201    0.1199507779         0.000000000        0.7426238917E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257493    
 intlbfgs> Highest QCI image energy=    0.8102998095E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998095E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1241    0.7973739946E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1156506353E-11        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257494    
 intlbfgs> Highest QCI image energy=    0.8102998096E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998096E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1242    0.7973739947E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1723528802E-11        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257494    
 intlbfgs> Highest QCI image energy=    0.8102998095E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998095E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1243    0.7973739947E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4392390987E-11        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257494    
 intlbfgs> Highest QCI image energy=    0.8102998094E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998094E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1244    0.7973739945E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3779702873E-11        15     3
 intlbfgs> Mean deviation     0.6422257494     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257494    
 intlbfgs> Highest QCI image energy=    0.8102998129E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998129E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1245    0.7973739975E-04   -0.1000000000+201    0.1199507781         0.000000000        0.1389691016E-10        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257493    
 intlbfgs> Highest QCI image energy=    0.8102998094E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998094E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1246    0.7973739945E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4684213469E-11        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257492    
 intlbfgs> Highest QCI image energy=    0.8102998090E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998090E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1247    0.7973739942E-04   -0.1000000000+201    0.1199507778         0.000000000        0.2395037055E-11        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257484    
 intlbfgs> Highest QCI image energy=    0.8102998083E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998083E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1248    0.7973739935E-04   -0.1000000000+201    0.1199507778         0.000000000        0.2060458186E-10        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998079E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998079E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1249    0.7973739930E-04   -0.1000000000+201    0.1199507778         0.000000000        0.7351443128E-11        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998087E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998087E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1250    0.7973739939E-04   -0.1000000000+201    0.1199507778         0.000000000        0.1446690200E-11        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1251    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6042650811E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1252    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4739721090E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1253    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9655840213E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1254    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8629739469E-12        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1255    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4209985623E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1256    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5378058658E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1257    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9975994671E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1258    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1506140224E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1259    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2588676498E-12        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1260    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5763392643E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1261    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9849192378E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998090E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998090E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1262    0.7973739942E-04   -0.1000000000+201    0.1199507778         0.000000000        0.3897370966E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998090E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998090E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1263    0.7973739941E-04   -0.1000000000+201    0.1199507778         0.000000000        0.3268610268E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998090E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998090E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1264    0.7973739941E-04   -0.1000000000+201    0.1199507778         0.000000000        0.5270624025E-12        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1265    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4008165575E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1266    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4732211371E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1267    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5471753246E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1268    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1389286530E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998093E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998093E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1269    0.7973739944E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2745351178E-12        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998093E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998093E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1270    0.7973739944E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2613209668E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1271    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.7342361840E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1272    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2171805581E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1273    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1910325638E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1274    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5711183986E-12        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1275    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5795698031E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1276    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2694675326E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1277    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4773929992E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1278    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3183471042E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1279    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2121131659E-14        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1280    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8178304661E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1281    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5023185025E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1282    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2090889441E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1283    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4882646636E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1284    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5993148645E-13        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998090E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998090E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1285    0.7973739941E-04   -0.1000000000+201    0.1199507778         0.000000000        0.9048996547E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1286    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8584399482E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1287    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8617433622E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1288    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4547450767E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1289    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4964706195E-14        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1290    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4419646286E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1291    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2073170030E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1292    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1245304282E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1293    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3334980930E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1294    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2858270026E-14        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1295    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2407514745E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1296    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9685088434E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1297    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9049565524E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1298    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8088810242E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1299    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4112593922E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 checkrep> number of active repulsions and total=      58      58
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1300    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1554080641E-15        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998093E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998093E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1301    0.7973739944E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1318981221E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1302    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1205859019E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1303    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2399130831E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1304    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1621568818E-13        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1305    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8490214044E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1306    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2170982382E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1307    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2347424873E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1308    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6019518048E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1309    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4962455903E-13        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998089E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998089E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1310    0.7973739941E-04   -0.1000000000+201    0.1199507778         0.000000000        0.7192858789E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1311    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.7036048628E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1312    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3737736062E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1313    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2824201459E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1314    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2559522266E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1315    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4630167059E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1316    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1819196672E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1317    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1451182917E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1318    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6700090084E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1319    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2484751720E-14        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1320    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1399873182E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1321    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6036571254E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1322    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2726074031E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1323    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2662459908E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1324    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2635099551E-13        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1325    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2291894780E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1326    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.7595666603E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998088E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998088E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1327    0.7973739938E-04   -0.1000000000+201    0.1199507778         0.000000000        0.2123811213E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1328    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2121950574E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1329    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3928120119E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1330    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1861289894E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1331    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1471504413E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1332    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3597323148E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998096E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998096E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1333    0.7973739945E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1979594491E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1334    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1979064074E-12        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1335    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8885371974E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998078E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998078E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1336    0.7973739934E-04   -0.1000000000+201    0.1199507778         0.000000000        0.7977451390E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1337    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.7977105292E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1338    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8032175390E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1339    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4574232562E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1340    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6306041573E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1341    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2505691277E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1342    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2399403415E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1343    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1954579770E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998096E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998096E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1344    0.7973739946E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5365561372E-12        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1345    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5390814656E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998078E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998078E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1346    0.7973739928E-04   -0.1000000000+201    0.1199507777         0.000000000        0.1018990939E-11        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1347    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1009065516E-11        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1348    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2234063626E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998099E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998099E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1349    0.7973739952E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4661238695E-12        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1350    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4621248272E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1351    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5452856677E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1352    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1784305998E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1353    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4858633457E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998089E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998089E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1354    0.7973739940E-04   -0.1000000000+201    0.1199507778         0.000000000        0.9556386820E-13        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1355    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9591230618E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1356    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3235618924E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1357    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2703186239E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1358    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1559231174E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1359    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4698090225E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1360    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5667467523E-16        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.9052296788     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257591    
 intlbfgs> Highest QCI image energy=    0.8102988300E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102988300E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1361    0.7973729156E-04   -0.1000000000+201    0.1199506962         0.000000000        0.4442593835E-09        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1362    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4442591746E-09        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1363    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8308359341E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1364    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1578088138E-14        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1365    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1165118826E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1366    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5944589353E-16        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257516    
 intlbfgs> Highest QCI image energy=    0.8102995266E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102995266E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1367    0.7973736703E-04   -0.1000000000+201    0.1199507533         0.000000000        0.1384790711E-09        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1368    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1384788143E-09        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1369    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1035201815E-14        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1370    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3128561621E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1371    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2836330658E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998090E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998090E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1372    0.7973739941E-04   -0.1000000000+201    0.1199507778         0.000000000        0.2048502423E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1373    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1925538423E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1374    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5701944686E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1375    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.7562528571E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1376    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6845428404E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1377    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4107257786E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1378    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3727649222E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1379    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2247759677E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1380    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2108001860E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1381    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9116668232E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1382    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6980564354E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1383    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4005344229E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1384    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.7982389431E-14        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1385    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.7642725422E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1386    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2800119067E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1387    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1532902093E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1388    0.7973739942E-04   -0.1000000000+201    0.1199507778         0.000000000        0.1408589554E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1389    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1398407651E-12        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1390    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8101183657E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998090E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998090E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1391    0.7973739941E-04   -0.1000000000+201    0.1199507778         0.000000000        0.4132808832E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1392    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4030328243E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1393    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1155586055E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1394    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1078106612E-12        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1395    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5742518818E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1396    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6609468618E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1397    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6566268006E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1398    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.7278685734E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1399    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3018666217E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 checkrep> number of active repulsions and total=      58      58
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1400    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4357940768E-15        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1401    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1680721097E-15        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1402    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2135394117E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998075E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998075E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1403    0.7973739935E-04   -0.1000000000+201    0.1199507778         0.000000000        0.1077768133E-11        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1404    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1078239538E-11        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1405    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5929772677E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1406    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4763140955E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1407    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4390054778E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1408    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4214042411E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1409    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2087860209E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1410    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6377791322E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1411    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5935931796E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1412    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5182110142E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1413    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2400917394E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1414    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1262635863E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1415    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5896193039E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998094E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998094E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1416    0.7973739944E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1736132258E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1417    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1745662618E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1418    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1040861014E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1419    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.7707007975E-14        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1420    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1068153464E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1421    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8310280744E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1422    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1374752132E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1423    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1832872552E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1424    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1559620000E-14        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1425    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5857126463E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1426    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.7751190812E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1427    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.7565385237E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1428    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8592195993E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1429    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2654300437E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1430    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1405783071E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1431    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1368641709E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1432    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3010492911E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1433    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1719125029E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1434    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1723977945E-12        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1435    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1522158867E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1436    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2522344136E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1437    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4745103787E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1438    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4529832178E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1439    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1030758651E-12        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1440    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9817442933E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1441    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9487502785E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1442    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2497641554E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1443    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2388928276E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1444    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3171223815E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1445    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1482503765E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1446    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1138304399E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1447    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1138515297E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1448    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4039922510E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1449    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8030296020E-16        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998093E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998093E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1450    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2172636301E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1451    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2171686350E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1452    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3008896561E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1453    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3745334629E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1454    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1898795292E-13        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1455    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1829121079E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1456    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1571479115E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1457    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8252213452E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1458    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4964050390E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1459    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8992263418E-16        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998089E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998089E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1460    0.7973739937E-04   -0.1000000000+201    0.1199507778         0.000000000        0.9913036834E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1461    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9916446526E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1462    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1543471657E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1463    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1267436399E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1464    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1080615495E-14        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1465    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5704137229E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1466    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5679597703E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1467    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3160167538E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1468    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5518901829E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1469    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3747998553E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1470    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2070066004E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1471    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4798341365E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1472    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2472318164E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1473    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1431367277E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1474    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1302071119E-13        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1475    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1083647776E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1476    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1472545388E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1477    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1373043027E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1478    0.7973739944E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6901181895E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1479    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6882687234E-12        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1480    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6311324417E-15        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1481    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3916910112E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1482    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1522527596E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998095E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998095E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1483    0.7973739945E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2650447227E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1484    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2638266806E-12        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1485    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2564032010E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1486    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2156582921E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1487    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2050693345E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1488    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1226625311E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1489    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1599243982E-14        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1490    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1432410874E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1491    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.7866064409E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1492    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5738148819E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1493    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2539833317E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1494    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1301559666E-13        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1495    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1298075434E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1496    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4263440667E-16        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998096E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998096E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1497    0.7973739946E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2242277315E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1498    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2235338269E-12        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1499    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9801982701E-14        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 checkrep> number of active repulsions and total=      58      58
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1500    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8667243496E-14        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1501    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2780245945E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1502    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4700348493E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1503    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4417005815E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1504    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.7361095493E-16        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1505    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5147196643E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296786     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257479    
 intlbfgs> Highest QCI image energy=    0.8102998100E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998100E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1506    0.7973739968E-04   -0.1000000000+201    0.1199507780         0.000000000        0.4066996544E-11        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1507    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4066139803E-11        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1508    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2109235529E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1509    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1950697635E-13        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1510    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4099568152E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1511    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4305505845E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1512    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3414619912E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998096E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998096E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1513    0.7973739948E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3752367346E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1514    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3747807681E-12        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1515    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8898196398E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1516    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1224926081E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1517    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6425176606E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1518    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6243713374E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1519    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6152929055E-13        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1520    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5773769264E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1521    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1012332310E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1522    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6403903456E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1523    0.7973739946E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3637591727E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1524    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3636321555E-12        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1525    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2506207234E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1526    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1621720138E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1527    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9322226929E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1528    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.7152953177E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1529    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8751182421E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1530    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6260023288E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1531    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3574192480E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1532    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1597563691E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1533    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9965787139E-15        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1534    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2406247082E-13        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1535    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2303403816E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1536    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1820364394E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998132E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998132E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1537    0.7973739998E-04   -0.1000000000+201    0.1199507783         0.000000000        0.3162573258E-11        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1538    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3161307001E-11        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1539    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1601630115E-13        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1540    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1318053360E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1541    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.7423290626E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1542    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2166845985E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1543    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2282079135E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1544    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1815572815E-14        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1545    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4322953142E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1546    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9718296006E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1547    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9704344380E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1548    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8362911949E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998093E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998093E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1549    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2184207394E-12        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1550    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2183415187E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1551    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9122199178E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998089E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998089E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1552    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3606529377E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1553    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3605669659E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1554    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9606582139E-16        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1555    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4574817840E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1556    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1208130369E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1557    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1202502978E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1558    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1477485686E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1559    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1952839363E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1560    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1102715538E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998098E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998098E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1561    0.7973739950E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3396158736E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1562    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3393224558E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1563    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5432741765E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1564    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3104815923E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1565    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2260274400E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1566    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1400042847E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998107E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998107E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1567    0.7973739959E-04   -0.1000000000+201    0.1199507780         0.000000000        0.8486331983E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1568    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8475564724E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1569    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4780605063E-14        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1570    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3667326079E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1571    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8275337625E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1572    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4581223400E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1573    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2520125981E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1574    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2511988436E-13        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1575    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2673490307E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998090E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998090E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1576    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1841621266E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1577    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1840362182E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1578    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.7799087566E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1579    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1618066829E-14        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1580    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1498035994E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1581    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1381691571E-15        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1582    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5242765806E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1583    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9331373988E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1584    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9554905973E-13        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1585    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2869557802E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1586    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1589047298E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1587    0.7973739942E-04   -0.1000000000+201    0.1199507778         0.000000000        0.6117279920E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1588    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6121825362E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1589    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9414137734E-14        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1590    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8571598890E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1591    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2549372628E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1592    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1504879299E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1593    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2980446241E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1594    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2977903371E-12        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1595    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9164853215E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1596    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2114137080E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998093E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998093E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1597    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8170748352E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1598    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8225743132E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1599    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1176686504E-13        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 checkrep> number of active repulsions and total=      58      58
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1600    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.7964338054E-14        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1601    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9942786089E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1602    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4498042633E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998100E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998100E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1603    0.7973739945E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6794093012E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1604    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6792273326E-12        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1605    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6503250689E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1606    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.7085326691E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998086E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998086E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1607    0.7973739939E-04   -0.1000000000+201    0.1199507778         0.000000000        0.4697140448E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1608    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4691122854E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1609    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2972463706E-13        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1610    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2810198978E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1611    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1638034301E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1612    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1413818622E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1613    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1413774535E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1614    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1735184713E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1615    0.7973739944E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1714286704E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1616    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1712468825E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1617    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2785170532E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1618    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2355244767E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1619    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1008575313E-14        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1620    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3097087732E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1621    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.7089169513E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1622    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2245930533E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1623    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1701206919E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1624    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2087718196E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1625    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2904099656E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1626    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6516809349E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998087E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998087E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1627    0.7973739939E-04   -0.1000000000+201    0.1199507778         0.000000000        0.1791772887E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1628    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1787705720E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1629    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3796488953E-14        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1630    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3332509796E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1631    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2760477722E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1632    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1731626732E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998094E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998094E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1633    0.7973739945E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9585936533E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1634    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9571342876E-13        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1635    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2867936097E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1636    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4234222262E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1637    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4156856057E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1638    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1979254250E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1639    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6712242379E-16        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1640    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3584089508E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1641    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3895938831E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1642    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3876031813E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1643    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6138106879E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1644    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5704993462E-14        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1645    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4655316854E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1646    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2661445743E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1647    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3061753461E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1648    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2249793613E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1649    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6437537763E-16        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1650    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1214435678E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1651    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2500845127E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1652    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1694593730E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1653    0.7973739944E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1374104731E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1654    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1380554381E-12        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1655    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2244492345E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1656    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9956136515E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1657    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3403705751E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1658    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1047659341E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1659    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1012951505E-12        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1660    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1009526344E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1661    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2423772374E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1662    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8302108482E-15        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1663    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2065425019E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1664    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2088816736E-14        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1665    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4544795017E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1666    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1345763515E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1667    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1307123372E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1668    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3844956320E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1669    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4258702092E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1670    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1120581568E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998089E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998089E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1671    0.7973739939E-04   -0.1000000000+201    0.1199507778         0.000000000        0.3447865148E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1672    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3463279180E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1673    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2226778100E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1674    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2248122080E-14        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998094E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998094E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1675    0.7973739945E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2371485487E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1676    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2363367112E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1677    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5400846248E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1678    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3592187430E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1679    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1485413013E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257479    
 intlbfgs> Highest QCI image energy=    0.8102998075E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998075E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1680    0.7973739944E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9495479982E-11        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1681    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9495837082E-11        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1682    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1465668231E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998074E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998074E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1683    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2298085555E-11        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1684    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2297766312E-11        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1685    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3082667690E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1686    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2289260115E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1687    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2185127900E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1688    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1360455028E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1689    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4795328865E-16        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998089E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998089E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1690    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4328838967E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1691    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4327305798E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1692    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1841488550E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1693    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1246421598E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1694    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3922118836E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1695    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.7110368825E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1696    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.7303487590E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1697    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4162305127E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1698    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2609864434E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1699    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6608613372E-14        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 checkrep> number of active repulsions and total=      58      58
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1700    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6063302301E-14        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1701    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2155291203E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1702    0.7973739941E-04   -0.1000000000+201    0.1199507778         0.000000000        0.1210298575E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1703    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1206805409E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1704    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.7515404462E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1705    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4116556901E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1706    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1472216511E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1707    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1002805537E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1708    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1126657872E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998110E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998110E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1709    0.7973739956E-04   -0.1000000000+201    0.1199507780         0.000000000        0.8562034958E-12        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1710    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8565412276E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1711    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1707543013E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1712    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3011104715E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1713    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2952918666E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1714    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6435873974E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1715    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2617866704E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1716    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1084963804E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998088E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998088E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1717    0.7973739938E-04   -0.1000000000+201    0.1199507778         0.000000000        0.2721430033E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1718    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2722022815E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1719    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5483062277E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1720    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2723845059E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1721    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1423722569E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1722    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1129892460E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1723    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5700470819E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1724    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2786542053E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1725    0.7973739941E-04   -0.1000000000+201    0.1199507778         0.000000000        0.1165517184E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1726    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1164171048E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1727    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2409088226E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1728    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1503016433E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1729    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1833855008E-14        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998089E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998089E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1730    0.7973739941E-04   -0.1000000000+201    0.1199507778         0.000000000        0.7104595534E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1731    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.7084804082E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1732    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4169515688E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1733    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2538719524E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1734    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1045566033E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1735    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1289888266E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1736    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1024906683E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1737    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5840641791E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1738    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2369592244E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1739    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1281427562E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1740    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6344191275E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1741    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1078351780E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1742    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1075530725E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1743    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1125566381E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998090E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998090E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1744    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2166941796E-12        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1745    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2165950833E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1746    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8444559632E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257480    
 intlbfgs> Highest QCI image energy=    0.8102998166E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998166E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1747    0.7973739952E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8763922877E-11        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1748    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8763829339E-11        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1749    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2943161691E-14        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1750    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2572110519E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1751    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4279967931E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1752    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3680496334E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998090E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998090E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1753    0.7973739941E-04   -0.1000000000+201    0.1199507778         0.000000000        0.8031594985E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1754    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8017362892E-13        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1755    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1473328563E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1756    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1074900845E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1757    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3299820122E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1758    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9998677039E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1759    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6187368216E-16        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998168E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998168E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1760    0.7973739834E-04   -0.1000000000+201    0.1199507770         0.000000000        0.2253398885E-10        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1761    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2253393844E-10        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1762    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5022043160E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1763    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4939095473E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1764    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2610772049E-14        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1765    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2467929344E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1766    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1316310408E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1767    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9537213579E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1768    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5036225701E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998089E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998089E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1769    0.7973739942E-04   -0.1000000000+201    0.1199507778         0.000000000        0.2722573943E-12        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1770    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2719099213E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1771    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1635053940E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1772    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8203263714E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1773    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5716078381E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1774    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3859805358E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1775    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6722166060E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1776    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4043121863E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1777    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2313080027E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1778    0.7973739941E-04   -0.1000000000+201    0.1199507778         0.000000000        0.1047797101E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1779    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1045289572E-12        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1780    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8971532635E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1781    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5843237119E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1782    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1155674608E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1783    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9784403721E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1784    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9086060806E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1785    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.7073393317E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1786    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1061444539E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1787    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2304793674E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1788    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2262209697E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1789    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4464017292E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1790    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1368552764E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1791    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1325208051E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1792    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3964637962E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998095E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998095E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1793    0.7973739944E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1585940394E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1794    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1584919243E-12        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1795    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2353810375E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1796    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1692591600E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1797    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3298556946E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1798    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3260671612E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1799    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9982847357E-14        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 checkrep> number of active repulsions and total=      58      58
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1800    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5911780449E-14        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1801    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2279852396E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998178E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998178E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1802    0.7973739966E-04   -0.1000000000+201    0.1199507780         0.000000000        0.7632153960E-11        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1803    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.7631843248E-11        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1804    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4112648369E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1805    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2247325359E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1806    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1020514151E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1807    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9739339436E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1808    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4575652405E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1809    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2281962566E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998089E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998089E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1810    0.7973739942E-04   -0.1000000000+201    0.1199507778         0.000000000        0.1374041530E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1811    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1376356388E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1812    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3527969510E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1813    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1332577351E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1814    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1154702910E-14        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1815    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1552026570E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1816    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6898340856E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998093E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998093E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1817    0.7973739944E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5718936684E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1818    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5698612706E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1819    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2470600417E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1820    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2246027467E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1821    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1579666062E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1822    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9116733851E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1823    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4267273743E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1824    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1320688514E-12        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1825    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1320034261E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1826    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8924383962E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1827    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8796641091E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1828    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4059292416E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1829    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3671409171E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1830    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4671508004E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998096E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998096E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1831    0.7973739942E-04   -0.1000000000+201    0.1199507778         0.000000000        0.6273208764E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1832    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6274703563E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1833    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1043142566E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1834    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8906075203E-14        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1835    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1583217583E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1836    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5695054661E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1837    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9948444973E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1838    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2375345356E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998086E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998086E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1839    0.7973739939E-04   -0.1000000000+201    0.1199507778         0.000000000        0.2456622779E-12        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1840    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2455648908E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1841    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8858609775E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1842    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5210853026E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1843    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4477110822E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1844    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3344699508E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1845    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1492171681E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1846    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.7798462118E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1847    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3725654426E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998101E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998101E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1848    0.7973739947E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6375637863E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1849    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6374851556E-12        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1850    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.7200624671E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1851    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5441933401E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1852    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3332188871E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998090E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998090E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1853    0.7973739941E-04   -0.1000000000+201    0.1199507778         0.000000000        0.6542558396E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1854    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6528693760E-13        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1855    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3685547216E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998097E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998097E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1856    0.7973739954E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8184653707E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1857    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8184156164E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1858    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3097038210E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1859    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2569723286E-14        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1860    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2595784908E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1861    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1720939475E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1862    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1706081627E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1863    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2219618019E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1864    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.7209929413E-16        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998090E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998090E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1865    0.7973739939E-04   -0.1000000000+201    0.1199507778         0.000000000        0.4480547942E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1866    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4495551251E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1867    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2248748892E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1868    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1934407683E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1869    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.7131132493E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1870    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6305620531E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1871    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6714443208E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1872    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6362663682E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1873    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3909918536E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1874    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9270740568E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1875    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8387856363E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1876    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2130869827E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1877    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1429014250E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1878    0.7973739942E-04   -0.1000000000+201    0.1199507778         0.000000000        0.8040312318E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1879    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.7943980038E-13        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1880    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1090972043E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1881    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8513406180E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1882    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9443918523E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1883    0.7973739947E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5569577822E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1884    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5563595332E-12        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1885    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1004486207E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1886    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3297240045E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1887    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1751082991E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1888    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1520718341E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1889    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3488392102E-13        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1890    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3197787449E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1891    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6924382172E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1892    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2048545062E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1893    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1998962049E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1894    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4798035087E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1895    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2719887850E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1896    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9601414064E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998095E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998095E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1897    0.7973739945E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1380407737E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1898    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1378047059E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1899    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3943464947E-14        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 checkrep> number of active repulsions and total=      58      58
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1900    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1817151679E-14        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1901    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3087915983E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1902    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3078920981E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1903    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3743657607E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1904    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2182936139E-14        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1905    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1314458710E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1906    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8048434970E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1907    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9336016520E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1908    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5750322959E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1909    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3239026918E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1910    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.7139894198E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998094E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998094E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1911    0.7973739944E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1575564355E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1912    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1574832008E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1913    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1757299592E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1914    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1702225309E-13        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1915    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3407464360E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1916    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2224443942E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1917    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4630887024E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1918    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4050595630E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1919    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5674129845E-16        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998095E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998095E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1920    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4380489463E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1921    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4380210898E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1922    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5544239606E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1923    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4904601299E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1924    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6027855041E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1925    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1812898997E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1926    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4550316201E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1927    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1149172854E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1928    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1146088060E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1929    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1087190433E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1930    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5782051255E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1931    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5625573675E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1932    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1409689577E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296786     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257355    
 intlbfgs> Highest QCI image energy=    0.8103003428E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8103003428E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1933    0.7973740024E-04   -0.1000000000+201    0.1199507785         0.000000000        0.1181586325E-08        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1934    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1181586188E-08        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1935    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1358811842E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998099E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998099E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1936    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1590340943E-11        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1937    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1590206738E-11        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1938    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1367250047E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998094E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998094E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1939    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1916025798E-12        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1940    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1922183125E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1941    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1299844470E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1942    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8675139077E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1943    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1175015795E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998108E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998108E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1944    0.7973739953E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8458243186E-12        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1945    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8455170607E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1946    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9220179714E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1947    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4979133835E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1948    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8163649584E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1949    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.7782273226E-14        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1950    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1134815458E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1951    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1410989921E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1952    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1335082903E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1953    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2196664802E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1954    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6747009673E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1955    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2329009386E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1956    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1441815637E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1957    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4249864285E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998089E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998089E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1958    0.7973739938E-04   -0.1000000000+201    0.1199507778         0.000000000        0.2431455014E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1959    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2435927784E-12        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1960    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9972538537E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1961    0.7973739946E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2982987670E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1962    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2981577344E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1963    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2063995655E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1964    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1997104996E-13        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1965    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2182061258E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1966    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8786865904E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1967    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1459558257E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1968    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1384248008E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1969    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1464677144E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1970    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1969147395E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1971    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1840479396E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1972    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1301514801E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1973    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5660865955E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1974    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2982849428E-16        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1975    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1407763679E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1976    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1176158857E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1977    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1171888153E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1978    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1429947323E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1979    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9500750027E-16        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1980    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9546415037E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1981    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5200331791E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1982    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8754063597E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1983    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.7621980517E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1984    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1230667126E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1985    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6535198301E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1986    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3034486627E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998093E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998093E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1987    0.7973739944E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4277885396E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1988    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4271106181E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1989    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1748029257E-15        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1990    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1023201370E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998098E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998098E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1991    0.7973739947E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2383185746E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1992    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2327398322E-12        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998052E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998052E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1993    0.7973739901E-04   -0.1000000000+201    0.1199507775         0.000000000        0.1668429390E-11        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1994    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1658199274E-11        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1995    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1609390556E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1996    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3826937338E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1997    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2995849536E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1998    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.7929420030E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1999    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.8338503708E-16        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 checkrep> number of active repulsions and total=      58      58
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2000    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4914770760E-16        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2001    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3557404262E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2002    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3474188139E-14        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2003    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.9759226645E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2004    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.4562544351E-16        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2005    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2026430127E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2006    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2018124209E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2007    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.2736457485E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2008    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1469360324E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2009    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.6877451237E-16        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2010    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.3375145596E-16        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998090E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998090E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2011    0.7973739941E-04   -0.1000000000+201    0.1199507778         0.000000000        0.5785982407E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2012    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.5772378723E-13        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2013    0.7973739942E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1779342709E-15        15     3
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998095E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998095E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2014    0.7973739945E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1520690873E-12        15     3
 intlbfgs> Mean deviation     0.6422257481     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.9052296787     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con      7 atoms      2    10 value=    0.79737E-04 d,ref,cutoff=     1.5865         1.7205        0.13316     max grad=    0.11995    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=     1.226957651        0.6422257481    
 intlbfgs> Highest QCI image energy=    0.8102998092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8102998092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2015    0.7973739943E-04   -0.1000000000+201    0.1199507779         0.000000000        0.1431326904E-12        15     3
 intlbfgs> energies for images:
     1        0.0000000000
     2        0.0000810300
     3        0.0000000000
 intlbfgs> After   2015 steps, energy/image=    0.8102998092E-04 RMS= 0.17710281E-11 images=   1
 intlbfgs> WORST=    0.8102998092E-04
 intlbfgs> retaining        1 QCI images, highest energy=    0.8102998092E-04
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 tryconnect> Number of proposed DNEB images        3 exceeds number from QCI. Redistributing.
 imageredistribution2> total distance=     2.453915302     regular spacing     0.6134788256    
 imageredistribution2> placing image      2 at image      1 energy     -273.6151510    
 imageredistribution2> placing image      3 at image      2 energy     -273.5810726    
 imageredistribution2> placing image      4 at image      2 energy     -273.5810726    
 imageredistribution2> new distances:
       1     0.000000000    
       2     0.000000000    
       3     1.219077813    
       4     1.219077813    
       5     2.453915302    
 tryconnect> 45-iteration DNEB run for      3 images with RMS convergence condition     0.1000000000E-03 newneb> Number of atoms or variables =           15
 KeyNEB> Initial and final NEB force constants     10.00000000        10.00000000     factor=    1.000000000    
 KeyNEB> Using 3 images
 KeyNEB> NEB coordinates will be saved to xyz file "neb.xyz" every 100 iterations
 KeyNEB> Energy profile will be saved to file "neb.EofS" every 100 iterations
 KeyNEB> Verbose printing is on
 KeyNEB> Evolution of AvDev, E, Rms and S will be saved to files "AvDevofI", "EofI", "RmsofI" and "SofI"
 rwg> NEB coordinates were saved to xyz file "neb.0.xyz"
                  Iter   Energy per image      RMS Force       Av.Dev    Path     Step length/images      k(1)
tangent vector problem for image        2 WMINUS and WPLUS=    0.2620292125E-01    0.9663381206E-12 EM=    -273.6151510    
 writeprofile> NEB profile was saved to file "neb.EofS.0"
 nebbfgs> steps:      1    -273.5925205         1.771921741       97.02%  2.45             0.70721E-02        10.000    
 nebbfgs> steps:      2    -273.5942344        0.9413292946       55.23%  2.45             0.10030            10.000    
 nebbfgs> steps:      3    -273.5949581        0.2541136491       20.39%  2.44             0.98049E-01        10.000    
 nebbfgs> steps:      4    -273.5945915        0.1692930552       18.19%  2.44             0.47096E-01        10.000    
 nebbfgs> steps:      5    -273.5940722        0.1470463425       11.65%  2.44             0.43423E-01        10.000    
 nebbfgs> steps:      6    -273.5949688        0.4146970994E-01    1.25%  2.44             0.56708E-01        10.000    
 nebbfgs> steps:      7    -273.5954895        0.6734798065E-01    0.67%  2.45             0.11774E-01        10.000    
 nebbfgs> steps:      8    -273.5954537        0.1693826427E-01    0.12%  2.44             0.67285E-02        10.000    
 nebbfgs> steps:      9    -273.5957620        0.1593639906E-01    0.24%  2.44             0.21298E-02        10.000    
 nebbfgs> steps:     10    -273.5976855        0.4063847214E-01    0.78%  2.45             0.14750E-01        10.000    
 nebbfgs> steps:     11    -273.5984836        0.3801608885E-01    0.62%  2.45             0.73714E-02        10.000    
 nebbfgs> steps:     12    -273.6021227        0.2055383723        1.00%  2.50             0.64052E-01        10.000    
 nebbfgs> steps:     13    -273.5988104        0.3133576252E-01    0.63%  2.45             0.58719E-01        10.000    
 nebbfgs> steps:     14    -273.5988027        0.4294356232E-01    0.52%  2.46             0.72451E-02        10.000    
 nebbfgs> steps:     15    -273.5989570        0.1179132293E-01    0.06%  2.46             0.43186E-02        10.000    
 nebbfgs> steps:     16    -273.5992976        0.1206960254E-01    0.11%  2.46             0.37248E-02        10.000    
 nebbfgs> steps:     17    -273.6010802        0.5603914496E-01    0.17%  2.47             0.22580E-01        10.000    
 nebbfgs> steps:     18    -273.6008971        0.3036819053E-01    0.14%  2.47             0.41866E-02        10.000    
 nebbfgs> steps:     19    -273.6009620        0.1270777867E-01    0.09%  2.47             0.12478E-02        10.000    
 nebbfgs> Decreasing DNEB force constant to      9.708737864    
 nebbfgs> steps:     20    -273.6021307        0.1354661549        0.35%  2.49             0.20706E-01        9.7087    
 nebbfgs> steps:     21    -273.6011173        0.1153039958E-01    0.05%  2.47             0.18293E-01        9.7087    
 nebbfgs> steps:     22    -273.6012236        0.1034385973E-01    0.03%  2.47             0.17497E-02        9.7087    
 nebbfgs> steps:     23    -273.6022976        0.4055177438E-01    0.11%  2.49             0.19228E-01        9.7087    
 nebbfgs> steps:     24    -273.6023142        0.2772089523E-01    0.10%  2.49             0.21693E-02        9.7087    
 nebbfgs> steps:     25    -273.6022547        0.9558083397E-02    0.09%  2.49             0.15616E-02        9.7087    
 nebbfgs> steps:     26    -273.6024883        0.1896367442E-01    0.11%  2.49             0.44618E-02        9.7087    
 nebbfgs> steps:     27    -273.6032477        0.4298049674E-01    0.20%  2.51             0.16281E-01        9.7087    
 nebbfgs> steps:     28    -273.6035009        0.3205475776E-01    0.21%  2.51             0.61162E-02        9.7087    
 nebbfgs> steps:     29    -273.6052505        0.4576281862        0.90%  2.67             0.92315E-01        9.7087    
 nebbfgs> steps:     30    -273.6034820        0.1516629579        0.09%  2.52             0.91987E-01        9.7087    
 nebbfgs> steps:     31    -273.5997499        0.2634787165        0.72%  2.50             0.41071E-01        9.7087    
 nebbfgs> steps:     32    -273.5984533        0.2233971954        0.71%  2.48             0.29903E-01        9.7087    
 nebbfgs> steps:     33    -273.5911201        0.1658558847        0.71%  2.45             0.93441E-01        9.7087    
 nebbfgs> steps:     34    -273.5932053        0.5195600503E-01    1.09%  2.44             0.33092E-01        9.7087    
 nebbfgs> steps:     35    -273.5948016        0.2505941494E-01    0.61%  2.44             0.15076E-01        9.7087    
 nebbfgs> steps:     36    -273.5964821        0.2076747201E-01    0.31%  2.45             0.13829E-01        9.7087    
 nebbfgs> steps:     37    -273.5984716        0.2720949730E-01    0.46%  2.45             0.16858E-01        9.7087    
 nebbfgs> steps:     38    -273.6002624        0.5575710495E-01    0.62%  2.47             0.20117E-01        9.7087    
 nebbfgs> steps:     39    -273.5995323        0.1599277579E-01    0.26%  2.46             0.10546E-01        9.7087    
 nebbfgs> Decreasing DNEB force constant to      9.425959091    
 nebbfgs> steps:     40    -273.6003130        0.1985584856E-01    0.30%  2.46             0.90743E-02        9.4260    
 nebbfgs> steps:     41    -273.6017322        0.3221043434E-01    0.44%  2.48             0.19960E-01        9.4260    
 nebbfgs> steps:     42    -273.6022598        0.3631823964E-01    0.42%  2.49             0.91330E-02        9.4260    
 nebbfgs> steps:     43    -273.6025981        0.4051239936E-01    0.29%  2.49             0.77419E-02        9.4260    
 nebbfgs> steps:     44    -273.6022354        0.2814335414E-01    0.20%  2.49             0.72835E-02        9.4260    
 nebbfgs> steps:     45    -273.6024874        0.4540504561E-01    0.24%  2.49             0.65082E-02        9.4260    
 nebbfgs> Final DNEB force constant      9.425959091    
 newneb> mean image separation is       0.6230
 writeprofile> NEB profile was saved to file "neb.EofS"
 rwg> NEB coordinates were saved to xyz file "neb.xyz"
 Time to go through NEB:   0.39343200000000000     
 Reached maximal number of iterations limit.
 time= 0.39 sec (0.01 sec/iteration)
 Following    1 images are candidates for TS:    2  
 Index of first candidate is            3
 bfgsts> resetting maximum uphill step size to     0.2000000000E-01

 BFGSTS> Beginning of optimization cycle    1.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.50844E-01   -0.50620E-01   -0.51067E-01  -273.597651732      -273.597656529      -273.597654105     0.259E-01
predicted gradient component=    0.2398487993E-02
xmylbfgs> Eigenvalue and RMS=   -0.5062043823E-01    0.2591738949E-01 after      0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.51282E-01   -0.51148E-01   -0.51416E-01  -273.597651793      -273.597656468      -273.597654105     0.254E-01
predicted gradient component=    0.2337265983E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.5114843571E-01   0.2536298340E-01    1.032284710     after      1 steps, step: 0.0030226998
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.64537E-01   -0.64452E-01   -0.64622E-01  -273.597653866      -273.597654409      -273.597654105     0.177E-01
predicted gradient component=    0.2714004950E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.6445166211E-01   0.1765821343E-01    20.64062580     after      2 steps, step: 0.1000000000
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.73810E-01   -0.73762E-01   -0.73857E-01  -273.597655606      -273.597652678      -273.597654105     0.184E-01
predicted gradient component=   -0.1464042981E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.7376241389E-01   0.1835450657E-01    12.62262348     after      3 steps, step: 0.1000000000
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.81057E-01   -0.81024E-01   -0.81090E-01  -273.597657286      -273.597651005      -273.597654105     0.176E-01
predicted gradient component=   -0.3140885497E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8102393285E-01   0.1762271309E-01    8.962190191     after      4 steps, step: 0.1000000000
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.86936E-01   -0.86866E-01   -0.87006E-01  -273.597658564      -273.597649733      -273.597654105     0.193E-01
predicted gradient component=   -0.4415668997E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8686567967E-01   0.1934545176E-01    6.725034376     after      5 steps, step: 0.1000000000
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.92092E-01   -0.91959E-01   -0.92225E-01  -273.597659545      -273.597648757      -273.597654105     0.183E-01
predicted gradient component=   -0.5394241981E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.9195890481E-01   0.1834650420E-01    5.538588305     after      6 steps, step: 0.1000000000
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.96555E-01   -0.96406E-01   -0.96704E-01  -273.597660224      -273.597648083      -273.597654105     0.153E-01
predicted gradient component=   -0.6070309524E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.9640618838E-01   0.1527127715E-01    4.613068558     after      7 steps, step: 0.1000000000
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.10017       -0.10001       -0.10032      -273.597660519      -273.597647791      -273.597654105     0.139E-01
predicted gradient component=   -0.6363951002E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.1000100602       0.1389835213E-01    3.603509313     after      8 steps, step: 0.1000000000
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.10265       -0.10254       -0.10276      -273.597660540      -273.597647773      -273.597654105     0.118E-01
predicted gradient component=   -0.6383802997E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.1025414003       0.1181339956E-01    2.468602967     after      9 steps, step: 0.1000000000
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.10430       -0.10412       -0.10449      -273.597660273      -273.597648041      -273.597654105     0.489E-02
predicted gradient component=   -0.6116308981E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.1041180484       0.4889834218E-02    1.514288964     after     10 steps, step: 0.0957428290
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.10454       -0.10444       -0.10463      -273.597660037      -273.597648277      -273.597654105     0.329E-02
predicted gradient component=   -0.5880032006E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.1044442277       0.3292573550E-02   0.3123000332     after     11 steps, step: 0.0180055996
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.10486       -0.10468       -0.10504      -273.597659792      -273.597648523      -273.597654105     0.264E-02
predicted gradient component=   -0.5634862504E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.1046770610       0.2639427242E-02   0.2224300329     after     12 steps, step: 0.0286235171
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.10490       -0.10467       -0.10514      -273.597659873      -273.597648442      -273.597654105     0.559E-02
predicted gradient component=   -0.5715522491E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.1046696664       0.5585951550E-02   0.7064637138E-02 after     13 steps, step: 0.0172708875
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.10491       -0.10477       -0.10505      -273.597659932      -273.597648383      -273.597654105     0.121E-02
predicted gradient component=   -0.5774270988E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.1047702104       0.1209177521E-02   0.9596622678E-01 after     14 steps, step: 0.0063677553
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.10490       -0.10479       -0.10501      -273.597660015      -273.597648300      -273.597654105     0.735E-03
predicted gradient component=   -0.5857829990E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.1047876282       0.7349196100E-03   0.1662198515E-01 after     15 steps, step: 0.0048985048
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.10477       -0.10480       -0.10473      -273.597660141      -273.597648173      -273.597654105     0.611E-03
predicted gradient component=   -0.5983958005E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.1048031317       0.6109885895E-03   0.1479295278E-01 after     16 steps, step: 0.0075518583
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.10491       -0.10481       -0.10500      -273.597660203      -273.597648112      -273.597654105     0.786E-03
predicted gradient component=   -0.6045697518E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.1048108316       0.7856178691E-03   0.7346514574E-02 after     17 steps, step: 0.0051324674
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.10495       -0.10481       -0.10509      -273.597660242      -273.597648073      -273.597654105     0.505E-03
predicted gradient component=   -0.6084533510E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.1048141902       0.5049914170E-03   0.3204260332E-02 after     18 steps, step: 0.0042464642
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.10494       -0.10482       -0.10506      -273.597660221      -273.597648094      -273.597654105     0.247E-03
predicted gradient component=   -0.6063743996E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.1048158967       0.2469235033E-03   0.1628137869E-02 after     19 steps, step: 0.0014931884
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.10492       -0.10482       -0.10502      -273.597660210      -273.597648105      -273.597654105     0.198E-03
predicted gradient component=   -0.6052457991E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.1048167865       0.1982909217E-03   0.8489054891E-03 after     20 steps, step: 0.0011303899
 xmylbfgs> Smallest eigenvalue converged in   20 steps. Eigenvalue=     -0.1048168 RMS force=      0.0001983 % change=    0.84891E-03
 xmylbfgs> Diagonal inverse Hessian elements are now         0.2421595222
beig> Overlap with previous vector=      0.7392532
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1   -0.605237E-02   -0.104817E+00 -0.200000E-01  0.220000E-01    0.325242E-01
 -------------------------------------------------------------------------------
 mylbfgs> Resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.5975545        0.5185286313E-02 after      0 steps
 mylbfgs> true and projected RMS:     0.5217575254E-02    0.5185286313E-02
 mylbfgs> Energy and RMS force=    -273.5975587        0.5177128104E-02 after      1 steps, step:  0.12099E-03
 mylbfgs> true and projected RMS:     0.5209480743E-02    0.5177128104E-02
 mylbfgs> Energy and RMS force=    -273.5981783        0.4484056591E-02 after      2 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.4524029521E-02    0.4484056591E-02
 mylbfgs> Energy and RMS force=    -273.5986924        0.3922067688E-02 after      3 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.3971173301E-02    0.3922067688E-02
 mylbfgs> Energy and RMS force=    -273.5991554        0.3294976477E-02 after      4 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.3358592094E-02    0.3294976477E-02
 bfgsts> RMS grad=    0.3358592094E-02 subspace grad=    0.3294976477E-02 unscaled EF step length=    0.5755110369E-01

 BFGSTS> Beginning of optimization cycle    2.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.94941E-01   -0.95196E-01   -0.94686E-01  -273.599159853      -273.599151125      -273.599155442     0.564E-02
predicted gradient component=   -0.4364252504E-02
xmylbfgs> Eigenvalue and RMS=   -0.9519637503E-01    0.5643728023E-02 after      0 steps
 xmylbfgs> Turning off convergence after 0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.95110E-01   -0.95194E-01   -0.95026E-01  -273.599159855      -273.599151123      -273.599155442     0.558E-02
predicted gradient component=   -0.4366111000E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.9519415316E-01   0.5581166422E-02   0.2334041273E-02 after      1 steps, step: 0.0001433325
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.95386E-01   -0.95544E-01   -0.95228E-01  -273.599160128      -273.599150851      -273.599155442     0.309E-02
predicted gradient component=   -0.4638719020E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.9554367157E-01   0.3086750526E-02   0.3658205849     after      2 steps, step: 0.0180379102
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.95552E-01   -0.95626E-01   -0.95478E-01  -273.599160318      -273.599150661      -273.599155442     0.348E-02
predicted gradient component=   -0.4828230999E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.9562571468E-01   0.3479291506E-02   0.8579607396E-01 after      3 steps, step: 0.0107153170
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.95608E-01   -0.95680E-01   -0.95536E-01  -273.599160395      -273.599150583      -273.599155442     0.214E-02
predicted gradient component=   -0.4906049980E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.9568026014E-01   0.2137587470E-02   0.5700805514E-01 after      4 steps, step: 0.0047314293
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.95633E-01   -0.95729E-01   -0.95537E-01  -273.599160552      -273.599150426      -273.599155442     0.103E-02
predicted gradient component=   -0.5062896491E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.9572866456E-01   0.1027734690E-02   0.5056418448E-01 after      5 steps, step: 0.0091406090
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.95676E-01   -0.95745E-01   -0.95607E-01  -273.599160611      -273.599150368      -273.599155442     0.919E-03
predicted gradient component=   -0.5121665026E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.9574465574E-01   0.9188662355E-03   0.1670190504E-01 after      6 steps, step: 0.0040205615
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.95577E-01   -0.95767E-01   -0.95387E-01  -273.599160760      -273.599150218      -273.599155442     0.200E-02
predicted gradient component=   -0.5270858509E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.9576734156E-01   0.2001079684E-02   0.2368847480E-01 after      7 steps, step: 0.0131638700
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.95726E-01   -0.95778E-01   -0.95674E-01  -273.599160806      -273.599150173      -273.599155442     0.128E-02
predicted gradient component=   -0.5316423000E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.9577805264E-01   0.1282837126E-02   0.1118323162E-01 after      8 steps, step: 0.0070620139
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.95750E-01   -0.95786E-01   -0.95714E-01  -273.599160762      -273.599150216      -273.599155442     0.383E-03
predicted gradient component=   -0.5272947988E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.9578557856E-01   0.3826111914E-03   0.7857044863E-02 after      9 steps, step: 0.0033726596
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.95597E-01   -0.95787E-01   -0.95407E-01  -273.599160753      -273.599150225      -273.599155442     0.280E-03
predicted gradient component=   -0.5263957519E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.9578728219E-01   0.2803023859E-03   0.1778551766E-02 after     10 steps, step: 0.0009532178
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.95600E-01   -0.95790E-01   -0.95410E-01  -273.599160750      -273.599150228      -273.599155442     0.257E-03
predicted gradient component=   -0.5261055975E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.9579036428E-01   0.2567104432E-03   0.3217546463E-02 after     11 steps, step: 0.0021616642
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.95762E-01   -0.95792E-01   -0.95732E-01  -273.599160755      -273.599150224      -273.599155442     0.317E-03
predicted gradient component=   -0.5265582018E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.9579181232E-01   0.3165016393E-03   0.1511645226E-02 after     12 steps, step: 0.0023807456
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.95771E-01   -0.95791E-01   -0.95752E-01  -273.599160762      -273.599150217      -273.599155442     0.416E-03
predicted gradient component=   -0.5272403513E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.9579052414E-01   0.4161822311E-03   0.1344784721E-02 after     13 steps, step: 0.0023586346
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.95740E-01   -0.95792E-01   -0.95688E-01  -273.599160760      -273.599150218      -273.599155442     0.639E-04
predicted gradient component=   -0.5270990016E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.9579237899E-01   0.6388878152E-04   0.1936327056E-02 after     14 steps, step: 0.0010582979
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.95671E-01   -0.95791E-01   -0.95551E-01  -273.599160760      -273.599150218      -273.599155442     0.503E-04
predicted gradient component=   -0.5270965517E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.9579122941E-01   0.5026993560E-04   0.1200095465E-02 after     15 steps, step: 0.0001473870
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.95787E-01   -0.95791E-01   -0.95783E-01  -273.599160760      -273.599150219      -273.599155442     0.627E-04
predicted gradient component=   -0.5270365506E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.9579103969E-01   0.6265478064E-04   0.1980563013E-03 after     16 steps, step: 0.0004036810
 xmylbfgs> Smallest eigenvalue converged in   16 steps. Eigenvalue=     -0.0957910 RMS force=      0.0000627 % change=    0.19806E-03
 xmylbfgs> Diagonal inverse Hessian elements are now         0.4705448247
beig> Overlap with previous vector=      0.9986548
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1   -0.527036E-02   -0.957910E-01 -0.220000E-01  0.242000E-01    0.396805E-01
 -------------------------------------------------------------------------------
 mylbfgs> Not resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.5990633        0.3256178788E-02 after      0 steps
 mylbfgs> true and projected RMS:     0.3288376204E-02    0.3256178788E-02
 mylbfgs> Energy and RMS force=    -273.5994353        0.3121859606E-02 after      1 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.3157815342E-02    0.3121859606E-02
 mylbfgs> Energy and RMS force=    -273.5997788        0.2499163635E-02 after      2 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.2548068950E-02    0.2499163635E-02
 mylbfgs> Energy and RMS force=    -273.6000642        0.2238587553E-02 after      3 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.2298486142E-02    0.2238587553E-02
 mylbfgs> Energy and RMS force=    -273.6003035        0.2290906702E-02 after      4 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.2356203805E-02    0.2290906702E-02
 bfgsts> RMS grad=    0.2356203805E-02 subspace grad=    0.2290906702E-02 unscaled EF step length=    0.5485379206E-01

 BFGSTS> Beginning of optimization cycle    3.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.86224E-01   -0.86668E-01   -0.85781E-01  -273.600307251      -273.600299859      -273.600303512     0.636E-02
predicted gradient component=   -0.3695567017E-02
xmylbfgs> Eigenvalue and RMS=   -0.8666763358E-01    0.6362566455E-02 after      0 steps
 xmylbfgs> Turning off convergence after 0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.86264E-01   -0.86667E-01   -0.85861E-01  -273.600307251      -273.600299859      -273.600303512     0.627E-02
predicted gradient component=   -0.3696394998E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8666671260E-01   0.6273698774E-02   0.1062666146E-02 after      1 steps, step: 0.0001821701
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.86830E-01   -0.87087E-01   -0.86573E-01  -273.600307369      -273.600299742      -273.600303512     0.302E-02
predicted gradient component=   -0.3813359996E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8708715235E-01   0.3015328114E-02   0.4827804548     after      2 steps, step: 0.0180831351
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.86876E-01   -0.87218E-01   -0.86534E-01  -273.600307482      -273.600299629      -273.600303512     0.329E-02
predicted gradient component=   -0.3926170024E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8721786824E-01   0.3285678067E-02   0.1498728349     after      3 steps, step: 0.0109819614
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.87108E-01   -0.87374E-01   -0.86842E-01  -273.600307675      -273.600299436      -273.600303512     0.294E-02
predicted gradient component=   -0.4119784990E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8737379351E-01   0.2941439519E-02   0.1784577068     after      4 steps, step: 0.0206024561
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.87099E-01   -0.87422E-01   -0.86777E-01  -273.600307865      -273.600299246      -273.600303512     0.356E-02
predicted gradient component=   -0.4309884503E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8742151824E-01   0.3558600088E-02   0.5459150793E-01 after      5 steps, step: 0.0168347770
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.87084E-01   -0.87473E-01   -0.86695E-01  -273.600307838      -273.600299273      -273.600303512     0.128E-02
predicted gradient component=   -0.4282757999E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8747315989E-01   0.1281366563E-02   0.5903714401E-01 after      6 steps, step: 0.0040249589
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.87142E-01   -0.87492E-01   -0.86792E-01  -273.600307843      -273.600299268      -273.600303512     0.101E-02
predicted gradient component=   -0.4287243001E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8749201036E-01   0.1013374190E-02   0.2154535705E-01 after      7 steps, step: 0.0032953232
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.87238E-01   -0.87516E-01   -0.86960E-01  -273.600307885      -273.600299227      -273.600303512     0.115E-02
predicted gradient component=   -0.4328931993E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8751588225E-01   0.1145708660E-02   0.2727721108E-01 after      8 steps, step: 0.0070424701
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.87192E-01   -0.87524E-01   -0.86860E-01  -273.600307948      -273.600299163      -273.600303512     0.219E-02
predicted gradient component=   -0.4392160008E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8752407168E-01   0.2194717358E-02   0.9356777567E-02 after      9 steps, step: 0.0099637632
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.87224E-01   -0.87540E-01   -0.86908E-01  -273.600307971      -273.600299140      -273.600303512     0.539E-03
predicted gradient component=   -0.4415292011E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8753966229E-01   0.5386011406E-03   0.1780975840E-01 after     10 steps, step: 0.0030168218
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.87210E-01   -0.87542E-01   -0.86878E-01  -273.600307974      -273.600299137      -273.600303512     0.370E-03
predicted gradient component=   -0.4418614992E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8754220980E-01   0.3695474645E-03   0.2910047281E-02 after     11 steps, step: 0.0010082248
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.87173E-01   -0.87545E-01   -0.86801E-01  -273.600307981      -273.600299130      -273.600303512     0.392E-03
predicted gradient component=   -0.4425085478E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8754520425E-01   0.3921563140E-03   0.3420455600E-02 after     12 steps, step: 0.0020811253
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.87214E-01   -0.87548E-01   -0.86880E-01  -273.600307984      -273.600299127      -273.600303512     0.291E-03
predicted gradient component=   -0.4428894016E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8754792506E-01   0.2906354183E-03   0.3107790756E-02 after     13 steps, step: 0.0026659497
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.87214E-01   -0.87546E-01   -0.86882E-01  -273.600307979      -273.600299132      -273.600303512     0.972E-03
predicted gradient component=   -0.4423350020E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8754598696E-01   0.9722943622E-03   0.2213809016E-02 after     14 steps, step: 0.0026865895
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.87225E-01   -0.87549E-01   -0.86901E-01  -273.600307984      -273.600299127      -273.600303512     0.811E-04
predicted gradient component=   -0.4428529508E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8754887222E-01   0.8105321077E-04   0.3295604904E-02 after     15 steps, step: 0.0010499768
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.87157E-01   -0.87549E-01   -0.86765E-01  -273.600307984      -273.600299127      -273.600303512     0.567E-04
predicted gradient component=   -0.4428083514E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8754850101E-01   0.5672490695E-04   0.4240091462E-03 after     16 steps, step: 0.0001635725
 xmylbfgs> Smallest eigenvalue converged in   16 steps. Eigenvalue=     -0.0875485 RMS force=      0.0000567 % change=    0.42401E-03
 xmylbfgs> Diagonal inverse Hessian elements are now         0.1410618879
beig> Overlap with previous vector=      0.9973660
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1   -0.442788E-02   -0.875485E-01 -0.242000E-01  0.266200E-01    0.487087E-01
 -------------------------------------------------------------------------------
 mylbfgs> Not resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6002228        0.2258998445E-02 after      0 steps
 mylbfgs> true and projected RMS:     0.2282809148E-02    0.2258998445E-02
 mylbfgs> Energy and RMS force=    -273.6004393        0.1863066398E-02 after      1 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1894322731E-02    0.1863066398E-02
 mylbfgs> Energy and RMS force=    -273.6006197        0.1929871068E-02 after      2 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1963249283E-02    0.1929871068E-02
 mylbfgs> Energy and RMS force=    -273.6007846        0.1642895962E-02 after      3 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1687120839E-02    0.1642895962E-02
 mylbfgs> Energy and RMS force=    -273.6009290        0.1555482773E-02 after      4 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1608213558E-02    0.1555482773E-02
 bfgsts> RMS grad=    0.1608213558E-02 subspace grad=    0.1555482773E-02 unscaled EF step length=    0.5044756899E-01

 BFGSTS> Beginning of optimization cycle    4.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.84034E-01   -0.84054E-01   -0.84014E-01  -273.600931733      -273.600926253      -273.600928951     0.612E-02
predicted gradient component=   -0.2739870979E-02
xmylbfgs> Eigenvalue and RMS=   -0.8405389033E-01    0.6116097815E-02 after      0 steps
 xmylbfgs> Turning off convergence after 0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.84044E-01   -0.84052E-01   -0.84036E-01  -273.600931733      -273.600926253      -273.600928951     0.603E-02
predicted gradient component=   -0.2739894001E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8405160944E-01   0.6033752675E-02   0.2713675235E-02 after      1 steps, step: 0.0001683299
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.84306E-01   -0.84467E-01   -0.84145E-01  -273.600931754      -273.600926232      -273.600928951     0.326E-02
predicted gradient component=   -0.2761168986E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8446711886E-01   0.3264346310E-02   0.4919185424     after      2 steps, step: 0.0178929679
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.84537E-01   -0.84627E-01   -0.84447E-01  -273.600931797      -273.600926189      -273.600928951     0.358E-02
predicted gradient component=   -0.2803728506E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8462697512E-01   0.3583089058E-02   0.1888951610     after      3 steps, step: 0.0126928167
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.84755E-01   -0.84802E-01   -0.84708E-01  -273.600931879      -273.600926108      -273.600928951     0.379E-02
predicted gradient component=   -0.2885399510E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8480230470E-01   0.3791543921E-02   0.2067509537     after      4 steps, step: 0.0261765492
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.84854E-01   -0.84885E-01   -0.84823E-01  -273.600931965      -273.600926022      -273.600928951     0.260E-02
predicted gradient component=   -0.2971593005E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8488474095E-01   0.2600782520E-02   0.9711551329E-01 after      5 steps, step: 0.0127709874
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.84819E-01   -0.84919E-01   -0.84719E-01  -273.600931972      -273.600926015      -273.600928951     0.134E-02
predicted gradient component=   -0.2978525515E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8491878977E-01   0.1344442416E-02   0.4009574454E-01 after      6 steps, step: 0.0033616619
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.84856E-01   -0.84943E-01   -0.84769E-01  -273.600932001      -273.600925986      -273.600928951     0.111E-02
predicted gradient component=   -0.3007822016E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8494329259E-01   0.1109123167E-02   0.2884609295E-01 after      7 steps, step: 0.0047600112
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.84918E-01   -0.84965E-01   -0.84872E-01  -273.600932050      -273.600925937      -273.600928951     0.117E-02
predicted gradient component=   -0.3056243997E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8496454682E-01   0.1174531800E-02   0.2501540547E-01 after      8 steps, step: 0.0066451565
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.84937E-01   -0.84967E-01   -0.84907E-01  -273.600932128      -273.600925859      -273.600928951     0.251E-02
predicted gradient component=   -0.3134851511E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8496732447E-01   0.2505012096E-02   0.3269080189E-02 after      9 steps, step: 0.0112903726
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.84853E-01   -0.84987E-01   -0.84719E-01  -273.600932131      -273.600925855      -273.600928951     0.593E-03
predicted gradient component=   -0.3137864496E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8498738332E-01   0.5932518761E-03   0.2360215471E-01 after     10 steps, step: 0.0022542755
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.84931E-01   -0.84990E-01   -0.84872E-01  -273.600932131      -273.600925855      -273.600928951     0.439E-03
predicted gradient component=   -0.3138043496E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8499033172E-01   0.4389422605E-03   0.3469101449E-02 after     11 steps, step: 0.0010461594
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.84972E-01   -0.84995E-01   -0.84949E-01  -273.600932142      -273.600925845      -273.600928951     0.455E-03
predicted gradient component=   -0.3148580987E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8499497360E-01   0.4545500440E-03   0.5461359330E-02 after     12 steps, step: 0.0028635637
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.84936E-01   -0.84998E-01   -0.84874E-01  -273.600932155      -273.600925832      -273.600928951     0.337E-03
predicted gradient component=   -0.3161692007E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8499830698E-01   0.3374563040E-03   0.3921700238E-02 after     13 steps, step: 0.0032957305
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.84990E-01   -0.84997E-01   -0.84983E-01  -273.600932165      -273.600925822      -273.600928951     0.973E-03
predicted gradient component=   -0.3171827984E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8499697628E-01   0.9734059248E-03   0.1565588775E-02 after     14 steps, step: 0.0031838654
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.84923E-01   -0.84999E-01   -0.84847E-01  -273.600932161      -273.600925825      -273.600928951     0.851E-04
predicted gradient component=   -0.3167953508E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8499924955E-01   0.8512431036E-04   0.2674468043E-02 after     15 steps, step: 0.0015873167
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.84966E-01   -0.85000E-01   -0.84932E-01  -273.600932161      -273.600925826      -273.600928951     0.698E-04
predicted gradient component=   -0.3167556002E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8500011348E-01   0.6977583801E-04   0.1016376643E-02 after     16 steps, step: 0.0001420201
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.84933E-01   -0.84999E-01   -0.84867E-01  -273.600932160      -273.600925826      -273.600928951     0.737E-04
predicted gradient component=   -0.3167058509E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8499939979E-01   0.7366073650E-04   0.8396353278E-03 after     17 steps, step: 0.0004978904
 xmylbfgs> Smallest eigenvalue converged in   17 steps. Eigenvalue=     -0.0849994 RMS force=      0.0000737 % change=    0.83964E-03
 xmylbfgs> Diagonal inverse Hessian elements are now         0.3727302367
beig> Overlap with previous vector=      0.9970145
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1   -0.316716E-02   -0.849994E-01 -0.266200E-01  0.292820E-01    0.556413E-01
 -------------------------------------------------------------------------------
 mylbfgs> Not resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6008759        0.1539296210E-02 after      0 steps
 mylbfgs> true and projected RMS:     0.1543665578E-02    0.1539296210E-02
 mylbfgs> Energy and RMS force=    -273.6009996        0.1537258003E-02 after      1 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1542570839E-02    0.1537258003E-02
 mylbfgs> Energy and RMS force=    -273.6011129        0.1506477204E-02 after      2 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1513228758E-02    0.1506477204E-02
 mylbfgs> Energy and RMS force=    -273.6012169        0.1510904467E-02 after      3 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1519475539E-02    0.1510904467E-02
 mylbfgs> Energy and RMS force=    -273.6013149        0.1507482697E-02 after      4 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1518721660E-02    0.1507482697E-02
 bfgsts> RMS grad=    0.1518721660E-02 subspace grad=    0.1507482697E-02 unscaled EF step length=    0.3720933613E-01

 BFGSTS> Beginning of optimization cycle    5.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.86445E-01   -0.85933E-01   -0.86957E-01  -273.601316201      -273.601313727      -273.601314921     0.591E-02
predicted gradient component=   -0.1237095489E-02
xmylbfgs> Eigenvalue and RMS=   -0.8593339901E-01    0.5908889548E-02 after      0 steps
 xmylbfgs> Turning off convergence after 0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.86441E-01   -0.85932E-01   -0.86950E-01  -273.601316200      -273.601313727      -273.601314921     0.584E-02
predicted gradient component=   -0.1236519495E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8593163344E-01   0.5835103658E-02   0.2054625403E-02 after      1 steps, step: 0.0001571174
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.86903E-01   -0.86358E-01   -0.87448E-01  -273.601316141      -273.601313787      -273.601314921     0.353E-02
predicted gradient component=   -0.1176684492E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8635827242E-01   0.3527663006E-02   0.4940337111     after      2 steps, step: 0.0187112551
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.87051E-01   -0.86542E-01   -0.87560E-01  -273.601316121      -273.601313807      -273.601314921     0.389E-02
predicted gradient component=   -0.1157123478E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8654159235E-01   0.3891032770E-02   0.2118287064     after      3 steps, step: 0.0146977566
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.87298E-01   -0.86708E-01   -0.87888E-01  -273.601316108      -273.601313820      -273.601314921     0.360E-02
predicted gradient component=   -0.1143875977E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8670788804E-01   0.3601224639E-02   0.1917884222     after      4 steps, step: 0.0248371762
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.87391E-01   -0.86787E-01   -0.87995E-01  -273.601316149      -273.601313779      -273.601314921     0.205E-02
predicted gradient component=   -0.1184976497E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8678714670E-01   0.2052912446E-02   0.9132533661E-01 after      5 steps, step: 0.0100167183
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.87334E-01   -0.86815E-01   -0.87853E-01  -273.601316173      -273.601313755      -273.601314921     0.130E-02
predicted gradient component=   -0.1208956007E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8681459835E-01   0.1298838759E-02   0.3162101095E-01 after      6 steps, step: 0.0033252499
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.87396E-01   -0.86840E-01   -0.87952E-01  -273.601316216      -273.601313712      -273.601314921     0.110E-02
predicted gradient component=   -0.1252192021E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8684013849E-01   0.1103112464E-02   0.2941052581E-01 after      7 steps, step: 0.0055825982
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.87369E-01   -0.86860E-01   -0.87878E-01  -273.601316267      -273.601313662      -273.601314921     0.120E-02
predicted gradient component=   -0.1302740515E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8685979701E-01   0.1200199104E-02   0.2263246702E-01 after      8 steps, step: 0.0075046757
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.87447E-01   -0.86867E-01   -0.88027E-01  -273.601316323      -273.601313605      -273.601314921     0.153E-02
predicted gradient component=   -0.1358848493E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8686688838E-01   0.1525388448E-02   0.8163492481E-02 after      9 steps, step: 0.0084141583
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.87305E-01   -0.86876E-01   -0.87734E-01  -273.601316318      -273.601313610      -273.601314921     0.526E-03
predicted gradient component=   -0.1354202510E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8687613222E-01   0.5260000498E-03   0.1064025251E-01 after     10 steps, step: 0.0016420354
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.87355E-01   -0.86879E-01   -0.87831E-01  -273.601316320      -273.601313609      -273.601314921     0.461E-03
predicted gradient component=   -0.1355427486E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8687921088E-01   0.4610699207E-03   0.3543605367E-02 after     11 steps, step: 0.0012978650
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.87319E-01   -0.86884E-01   -0.87754E-01  -273.601316334      -273.601313594      -273.601314921     0.442E-03
predicted gradient component=   -0.1369839509E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8688365998E-01   0.4424942048E-03   0.5120758322E-02 after     12 steps, step: 0.0030252667
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.87305E-01   -0.86886E-01   -0.87724E-01  -273.601316354      -273.601313574      -273.601314921     0.346E-03
predicted gradient component=   -0.1389744483E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8688627059E-01   0.3459144263E-03   0.3004633559E-02 after     13 steps, step: 0.0035038097
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.87471E-01   -0.86885E-01   -0.88057E-01  -273.601316364      -273.601313564      -273.601314921     0.797E-03
predicted gradient component=   -0.1399991504E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8688500959E-01   0.7967704640E-03   0.1451351668E-02 after     14 steps, step: 0.0020456993
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.87489E-01   -0.86887E-01   -0.88091E-01  -273.601316358      -273.601313571      -273.601314921     0.807E-04
predicted gradient component=   -0.1393587496E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8688704220E-01   0.8065266845E-04   0.2339379664E-02 after     15 steps, step: 0.0014059272
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.87355E-01   -0.86887E-01   -0.87823E-01  -273.601316358      -273.601313571      -273.601314921     0.618E-04
predicted gradient component=   -0.1393669521E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.8688675628E-01   0.6179206383E-04   0.3290794678E-03 after     16 steps, step: 0.0000910131
 xmylbfgs> Smallest eigenvalue converged in   16 steps. Eigenvalue=     -0.0868868 RMS force=      0.0000618 % change=    0.32908E-03
 xmylbfgs> Diagonal inverse Hessian elements are now         0.1478675211
beig> Overlap with previous vector=      0.9971580
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1   -0.139381E-02   -0.868868E-01 -0.160376E-01  0.300000E-01    0.322087E-01
 -------------------------------------------------------------------------------
 mylbfgs> Not resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6013040        0.1507327289E-02 after      0 steps
 mylbfgs> true and projected RMS:     0.1507342376E-02    0.1507327289E-02
 mylbfgs> Energy and RMS force=    -273.6013970        0.1605142653E-02 after      1 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1605143996E-02    0.1605142653E-02
 mylbfgs> Energy and RMS force=    -273.6014893        0.1598159100E-02 after      2 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1598174158E-02    0.1598159100E-02
 mylbfgs> Energy and RMS force=    -273.6015804        0.1689718090E-02 after      3 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1689827998E-02    0.1689718090E-02
 mylbfgs> Resetting LBFGS routine - step scaling factor was     0.8648337425E-01
 mylbfgs> Energy and RMS force=    -273.6015806        0.1688359359E-02 after      4 steps, step:  0.12848E-04
 mylbfgs> true and projected RMS:     0.1688469503E-02    0.1688359359E-02
 bfgsts> RMS grad=    0.1688469503E-02 subspace grad=    0.1688359359E-02 unscaled EF step length=    0.1603756362E-01

 BFGSTS> Beginning of optimization cycle    6.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.88673E-01   -0.88803E-01   -0.88543E-01  -273.601580724      -273.601580466      -273.601580550     0.367E-02
predicted gradient component=   -0.1291744809E-03
xmylbfgs> Eigenvalue and RMS=   -0.8880252683E-01    0.3668282541E-02 after      0 steps
 xmylbfgs> Turning off convergence after 0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.88609E-01   -0.88796E-01   -0.88422E-01  -273.601580724      -273.601580466      -273.601580550     0.364E-02
predicted gradient component=   -0.1289264731E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8879583877E-01   0.3637561597E-02   0.7531953301E-02 after      1 steps, step: 0.0000605533
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.88762E-01   -0.88964E-01   -0.88560E-01  -273.601580675      -273.601580515      -273.601580550     0.265E-02
predicted gradient component=   -0.7981000749E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.8896406355E-01   0.2651724315E-02   0.1890929563     after      2 steps, step: 0.0115554498
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.88919E-01   -0.89059E-01   -0.88779E-01  -273.601580632      -273.601580557      -273.601580550     0.294E-02
predicted gradient component=   -0.3744949595E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.8905862099E-01   0.2939543639E-02   0.1061743749     after      3 steps, step: 0.0119555109
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.88916E-01   -0.89126E-01   -0.88706E-01  -273.601580614      -273.601580576      -273.601580550     0.206E-02
predicted gradient component=   -0.1933199201E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.8912564611E-01   0.2057295599E-02   0.7520295987E-01 after      4 steps, step: 0.0108814309
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.88946E-01   -0.89162E-01   -0.88730E-01  -273.601580624      -273.601580565      -273.601580550     0.100E-02
predicted gradient component=   -0.2953700573E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.8916158549E-01   0.1001873403E-02   0.4030814297E-01 after      5 steps, step: 0.0076448113
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.89023E-01   -0.89175E-01   -0.88871E-01  -273.601580643      -273.601580547      -273.601580550     0.932E-03
predicted gradient component=   -0.4801751174E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.8917486044E-01   0.9318918731E-03   0.1488642341E-01 after      6 steps, step: 0.0040924053
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.89108E-01   -0.89186E-01   -0.89030E-01  -273.601580670      -273.601580519      -273.601580550     0.824E-03
predicted gradient component=   -0.7549701309E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.8918564038E-01   0.8235877628E-03   0.1208708750E-01 after      7 steps, step: 0.0040141317
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.89088E-01   -0.89193E-01   -0.88983E-01  -273.601580707      -273.601580483      -273.601580550     0.105E-02
predicted gradient component=   -0.1123079869E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8919254734E-01   0.1047422365E-02   0.7743877352E-02 after      8 steps, step: 0.0058051773
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.89040E-01   -0.89197E-01   -0.88883E-01  -273.601580722      -273.601580467      -273.601580550     0.504E-03
predicted gradient component=   -0.1274180192E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8919693179E-01   0.5038322222E-03   0.4915466432E-02 after      9 steps, step: 0.0024191277
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.89080E-01   -0.89198E-01   -0.88962E-01  -273.601580720      -273.601580470      -273.601580550     0.346E-03
predicted gradient component=   -0.1246429804E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8919846041E-01   0.3458295888E-03   0.1713727601E-02 after     10 steps, step: 0.0008676812
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.89061E-01   -0.89202E-01   -0.88920E-01  -273.601580728      -273.601580462      -273.601580550     0.234E-03
predicted gradient component=   -0.1332884949E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8920153604E-01   0.2337384290E-03   0.3447963398E-02 after     11 steps, step: 0.0020273331
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.89009E-01   -0.89203E-01   -0.88815E-01  -273.601580745      -273.601580445      -273.601580550     0.228E-03
predicted gradient component=   -0.1498154916E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8920253878E-01   0.2277384948E-03   0.1124109516E-02 after     12 steps, step: 0.0024916434
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.89006E-01   -0.89201E-01   -0.88811E-01  -273.601580761      -273.601580429      -273.601580550     0.761E-03
predicted gradient component=   -0.1659250017E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8920112232E-01   0.7614273106E-03   0.1587942064E-02 after     13 steps, step: 0.0025176549
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.89040E-01   -0.89203E-01   -0.88877E-01  -273.601580753      -273.601580437      -273.601580550     0.568E-04
predicted gradient component=   -0.1583249798E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8920292526E-01   0.5683364755E-04   0.2021169859E-02 after     14 steps, step: 0.0013867899
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.89004E-01   -0.89203E-01   -0.88805E-01  -273.601580753      -273.601580436      -273.601580550     0.459E-04
predicted gradient component=   -0.1585179916E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8920306126E-01   0.4589043749E-04   0.1524680510E-03 after     15 steps, step: 0.0000922235
 xmylbfgs> Smallest eigenvalue converged in   15 steps. Eigenvalue=     -0.0892031 RMS force=      0.0000459 % change=    0.15247E-03
 xmylbfgs> Diagonal inverse Hessian elements are now         0.1495990422
beig> Overlap with previous vector=      0.9988189
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1   -0.158750E-03   -0.892031E-01 -0.177964E-02  0.300000E-01    0.449665E-02
 -------------------------------------------------------------------------------
 mylbfgs> Not resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6015804        0.1688403594E-02 after      0 steps
 mylbfgs> true and projected RMS:     0.1688403597E-02    0.1688403594E-02
 mylbfgs> Energy and RMS force=    -273.6017436        0.1343009707E-02 after      1 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1343011499E-02    0.1343009707E-02
 mylbfgs> Energy and RMS force=    -273.6018567        0.1545075287E-02 after      2 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1545076554E-02    0.1545075287E-02
 mylbfgs> Energy and RMS force=    -273.6019445        0.1624590891E-02 after      3 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1624591852E-02    0.1624590891E-02
 mylbfgs> Energy and RMS force=    -273.6020259        0.1459166280E-02 after      4 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1459166362E-02    0.1459166280E-02
 bfgsts> RMS grad=    0.1459166362E-02 subspace grad=    0.1459166280E-02 unscaled EF step length=    0.1779641329E-02

 BFGSTS> Beginning of optimization cycle    7.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.97924E-01   -0.97828E-01   -0.98020E-01  -273.602025898      -273.602025905      -273.602025853     0.416E-02
predicted gradient component=    0.3352994327E-05
xmylbfgs> Eigenvalue and RMS=   -0.9782775174E-01    0.4157384087E-02 after      0 steps
 xmylbfgs> Turning off convergence after 0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.97897E-01   -0.97823E-01   -0.97971E-01  -273.602025898      -273.602025905      -273.602025853     0.413E-02
predicted gradient component=    0.3286487527E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.9782324146E-01   0.4125901112E-02   0.4610648888E-02 after      1 steps, step: 0.0000777773
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.98057E-01   -0.97929E-01   -0.98185E-01  -273.602025886      -273.602025917      -273.602025853     0.399E-02
predicted gradient component=    0.1564649210E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.9792931494E-01   0.3989240695E-02   0.1083163694     after      2 steps, step: 0.0142960761
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.98032E-01   -0.97994E-01   -0.98070E-01  -273.602025881      -273.602025922      -273.602025853     0.169E-02
predicted gradient component=    0.2039598712E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.9799401513E-01   0.1688866305E-02   0.6602463831E-01 after      3 steps, step: 0.0047524672
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.98088E-01   -0.98006E-01   -0.98170E-01  -273.602025875      -273.602025928      -273.602025853     0.112E-02
predicted gradient component=    0.2637000307E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.9800589341E-01   0.1118602091E-02   0.1211996874E-01 after      4 steps, step: 0.0016441705
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.98049E-01   -0.98030E-01   -0.98068E-01  -273.602025850      -273.602025953      -273.602025853     0.637E-03
predicted gradient component=    0.5126449310E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.9802975843E-01   0.6371838902E-03   0.2434466094E-01 after      5 steps, step: 0.0060683259
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.98122E-01   -0.98038E-01   -0.98206E-01  -273.602025836      -273.602025967      -273.602025853     0.589E-03
predicted gradient component=    0.6569999300E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.9803799024E-01   0.5890345900E-03   0.8396558343E-02 after      6 steps, step: 0.0040245551
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.98075E-01   -0.98041E-01   -0.98109E-01  -273.602025813      -273.602025990      -273.602025853     0.146E-02
predicted gradient component=    0.8846649280E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.9804100540E-01   0.1463674984E-02   0.3075400758E-02 after      7 steps, step: 0.0070657145
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.98096E-01   -0.98049E-01   -0.98143E-01  -273.602025818      -273.602025985      -273.602025853     0.410E-03
predicted gradient component=    0.8338500379E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.9804902497E-01   0.4098709312E-03   0.8179142112E-02 after      8 steps, step: 0.0016065445
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.98112E-01   -0.98051E-01   -0.98173E-01  -273.602025820      -273.602025983      -273.602025853     0.259E-03
predicted gradient component=    0.8188797551E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.9805097270E-01   0.2585808614E-03   0.1986452356E-02 after      9 steps, step: 0.0011128742
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.98023E-01   -0.98053E-01   -0.97993E-01  -273.602025818      -273.602025985      -273.602025853     0.278E-03
predicted gradient component=    0.8336351698E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.9805275732E-01   0.2782301882E-03   0.1820057619E-02 after     10 steps, step: 0.0024921334
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.98144E-01   -0.98050E-01   -0.98238E-01  -273.602025815      -273.602025988      -273.602025853     0.763E-03
predicted gradient component=    0.8611101521E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.9805027282E-01   0.7625853172E-03   0.2533907223E-02 after     11 steps, step: 0.0023811410
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.98109E-01   -0.98052E-01   -0.98166E-01  -273.602025816      -273.602025988      -273.602025853     0.126E-03
predicted gradient component=    0.8592951417E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.9805202586E-01   0.1257883536E-03   0.1787871867E-02 after     12 steps, step: 0.0009474192
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.98155E-01   -0.98052E-01   -0.98258E-01  -273.602025815      -273.602025988      -273.602025853     0.831E-04
predicted gradient component=    0.8658250295E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.9805175061E-01   0.8306139866E-04   0.2807225521E-03 after     13 steps, step: 0.0001891744
 xmylbfgs> Smallest eigenvalue converged in   13 steps. Eigenvalue=     -0.0980518 RMS force=      0.0000831 % change=    0.28072E-03
 xmylbfgs> Diagonal inverse Hessian elements are now         0.1463221429
beig> Overlap with previous vector=      0.9995974
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1    0.864827E-04   -0.980518E-01  0.882010E-03  0.300000E-01    0.139719E-02
 -------------------------------------------------------------------------------
 mylbfgs> Not resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6020258        0.1459090578E-02 after      0 steps
 mylbfgs> true and projected RMS:     0.1459090578E-02    0.1459090578E-02
 mylbfgs> Energy and RMS force=    -273.6021064        0.1590788301E-02 after      1 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1590788301E-02    0.1590788301E-02
 mylbfgs> Energy and RMS force=    -273.6021889        0.1513067094E-02 after      2 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1513067116E-02    0.1513067094E-02
 mylbfgs> Energy and RMS force=    -273.6022730        0.1532803709E-02 after      3 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1532804116E-02    0.1532803709E-02
 mylbfgs> Energy and RMS force=    -273.6023578        0.1513779152E-02 after      4 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1513781187E-02    0.1513779152E-02
 mylbfgs> Resetting LBFGS routine - step scaling factor was     0.6525636981E-01
 bfgsts> RMS grad=    0.1513781187E-02 subspace grad=    0.1513779152E-02 unscaled EF step length=    0.8820102447E-03

 BFGSTS> Beginning of optimization cycle    8.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.98098E-01   -0.97768E-01   -0.98428E-01  -273.602357887      -273.602357853      -273.602357821     0.273E-02
predicted gradient component=   -0.1664798788E-04
xmylbfgs> Eigenvalue and RMS=   -0.9776835191E-01    0.2732721073E-02 after      0 steps
 xmylbfgs> Turning off convergence after 0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.98081E-01   -0.97761E-01   -0.98402E-01  -273.602357887      -273.602357853      -273.602357821     0.272E-02
predicted gradient component=   -0.1667149263E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.9776052644E-01   0.2717961348E-02   0.8004739824E-02 after      1 steps, step: 0.0000336049
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.98112E-01   -0.97757E-01   -0.98467E-01  -273.602357914      -273.602357826      -273.602357821     0.445E-02
predicted gradient component=   -0.4435301548E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.9775673112E-01   0.4448790130E-02   0.3882415173E-02 after      2 steps, step: 0.0104443604
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.98195E-01   -0.97827E-01   -0.98563E-01  -273.602357909      -273.602357831      -273.602357821     0.114E-02
predicted gradient component=   -0.3880151667E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.9782716353E-01   0.1141096073E-02   0.7199678147E-01 after      3 steps, step: 0.0045040825
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.98121E-01   -0.97838E-01   -0.98404E-01  -273.602357914      -273.602357825      -273.602357821     0.822E-03
predicted gradient component=   -0.4455949920E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.9783792243E-01   0.8217110587E-03   0.1099666424E-01 after      4 steps, step: 0.0017810901
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.98188E-01   -0.97858E-01   -0.98518E-01  -273.602357939      -273.602357800      -273.602357821     0.847E-03
predicted gradient component=   -0.6953001730E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.9785759687E-01   0.8465708164E-03   0.2010517002E-01 after      5 steps, step: 0.0063764207
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.98232E-01   -0.97861E-01   -0.98603E-01  -273.602357959      -273.602357781      -273.602357821     0.132E-02
predicted gradient component=   -0.8875599633E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.9786078407E-01   0.1324913149E-02   0.3256870244E-02 after      6 steps, step: 0.0043318207
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.98230E-01   -0.97866E-01   -0.98594E-01  -273.602357961      -273.602357779      -273.602357821     0.440E-03
predicted gradient component=   -0.9121299627E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.9786602133E-01   0.4397229888E-03   0.5351457087E-02 after      7 steps, step: 0.0010666468
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.98235E-01   -0.97868E-01   -0.98602E-01  -273.602357965      -273.602357775      -273.602357821     0.274E-03
predicted gradient component=   -0.9505350818E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.9786802909E-01   0.2741228742E-03   0.2051500184E-02 after      8 steps, step: 0.0009677061
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.98253E-01   -0.97869E-01   -0.98637E-01  -273.602357971      -273.602357769      -273.602357821     0.306E-03
predicted gradient component=   -0.1012485029E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.9786929417E-01   0.3063987353E-03   0.1292624825E-02 after      9 steps, step: 0.0015348066
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.98197E-01   -0.97871E-01   -0.98523E-01  -273.602357978      -273.602357762      -273.602357821     0.222E-03
predicted gradient component=   -0.1078154810E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.9787098565E-01   0.2221369996E-03   0.1728273533E-02 after     10 steps, step: 0.0019654339
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.98166E-01   -0.97871E-01   -0.98461E-01  -273.602357985      -273.602357755      -273.602357821     0.468E-03
predicted gradient component=   -0.1146329964E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.9787128254E-01   0.4681146833E-03   0.3033482111E-03 after     11 steps, step: 0.0020775985
 xmylbfgs> Smallest eigenvalue converged in   11 steps. Eigenvalue=     -0.0978713 RMS force=      0.0004681 % change=    0.30335E-03
 xmylbfgs> Diagonal inverse Hessian elements are now         1.0415582230
beig> Overlap with previous vector=      0.9997667
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1   -0.114688E-03   -0.978713E-01 -0.117182E-02  0.300000E-01    0.186744E-02
 -------------------------------------------------------------------------------
 mylbfgs> Not resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6023578        0.1513676817E-02 after      0 steps
 mylbfgs> true and projected RMS:     0.1513676817E-02    0.1513676817E-02
 mylbfgs> Energy and RMS force=    -273.6023579        0.1512813843E-02 after      1 steps, step:  0.10310E-04
 mylbfgs> true and projected RMS:     0.1512813843E-02    0.1512813843E-02
 mylbfgs> Energy and RMS force=    -273.6025107        0.1037217739E-02 after      2 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1037228890E-02    0.1037217739E-02
 mylbfgs> Energy and RMS force=    -273.6026088        0.1081193539E-02 after      3 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1081307216E-02    0.1081193539E-02
 mylbfgs> Energy and RMS force=    -273.6026729        0.1469292813E-02 after      4 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1469633458E-02    0.1469292813E-02
 bfgsts> RMS grad=    0.1469633458E-02 subspace grad=    0.1469292813E-02 unscaled EF step length=    0.1171821573E-02

 BFGSTS> Beginning of optimization cycle    9.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.88306E-01   -0.88013E-01   -0.88599E-01  -273.602673189      -273.602672765      -273.602672933     0.390E-02
predicted gradient component=   -0.2121559817E-03
xmylbfgs> Eigenvalue and RMS=   -0.8801311218E-01    0.3902607913E-02 after      0 steps
 xmylbfgs> Turning off convergence after 0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.88218E-01   -0.88008E-01   -0.88427E-01  -273.602673189      -273.602672765      -273.602672933     0.387E-02
predicted gradient component=   -0.2120430054E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8800845117E-01   0.3871186158E-02   0.5296092650E-02 after      1 steps, step: 0.0000685366
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.88472E-01   -0.88172E-01   -0.88771E-01  -273.602673180      -273.602672774      -273.602672933     0.290E-02
predicted gradient component=   -0.2033359863E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8817245327E-01   0.2900656841E-02   0.1860015158     after      2 steps, step: 0.0127224611
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.88366E-01   -0.88245E-01   -0.88487E-01  -273.602673188      -273.602672766      -273.602672933     0.244E-02
predicted gradient component=   -0.2105510077E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8824491602E-01   0.2436434436E-02   0.8211549641E-01 after      3 steps, step: 0.0086130845
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.88586E-01   -0.88285E-01   -0.88888E-01  -273.602673190      -273.602672765      -273.602672933     0.184E-02
predicted gradient component=   -0.2125339904E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8828453714E-01   0.1836947217E-02   0.4487888019E-01 after      4 steps, step: 0.0056045344
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.88421E-01   -0.88320E-01   -0.88522E-01  -273.602673204      -273.602672751      -273.602672933     0.100E-02
predicted gradient component=   -0.2264974910E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8832017213E-01   0.1002540664E-02   0.4034751982E-01 after      5 steps, step: 0.0098837468
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.88483E-01   -0.88332E-01   -0.88634E-01  -273.602673220      -273.602672734      -273.602672933     0.915E-03
predicted gradient component=   -0.2430794837E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8833208265E-01   0.9152151366E-03   0.1348379497E-01 after      6 steps, step: 0.0034853362
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.88634E-01   -0.88343E-01   -0.88925E-01  -273.602673239      -273.602672715      -273.602672933     0.828E-03
predicted gradient component=   -0.2619509871E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8834273620E-01   0.8281676330E-03   0.1205934098E-01 after      7 steps, step: 0.0036882413
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.88557E-01   -0.88350E-01   -0.88763E-01  -273.602673292      -273.602672662      -273.602672933     0.119E-02
predicted gradient component=   -0.3151234864E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8835036552E-01   0.1185318113E-02   0.8635293636E-02 after      8 steps, step: 0.0087828415
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.88565E-01   -0.88356E-01   -0.88774E-01  -273.602673294      -273.602672660      -273.602672933     0.683E-03
predicted gradient component=   -0.3166605040E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8835604126E-01   0.6832623056E-03   0.6423720196E-02 after      9 steps, step: 0.0025715001
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.88654E-01   -0.88358E-01   -0.88950E-01  -273.602673290      -273.602672664      -273.602672933     0.257E-03
predicted gradient component=   -0.3127250068E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8835801922E-01   0.2565736443E-03   0.2238575025E-02 after     10 steps, step: 0.0013770790
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.88613E-01   -0.88359E-01   -0.88867E-01  -273.602673291      -273.602672663      -273.602672933     0.196E-03
predicted gradient component=   -0.3140515048E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8835882257E-01   0.1961504693E-03   0.9091878797E-03 after     11 steps, step: 0.0005979470
 xmylbfgs> Smallest eigenvalue converged in   11 steps. Eigenvalue=     -0.0883588 RMS force=      0.0001962 % change=    0.90919E-03
 xmylbfgs> Diagonal inverse Hessian elements are now         0.1817916860
beig> Overlap with previous vector=      0.9991272
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1   -0.314138E-03   -0.883588E-01 -0.355521E-02  0.300000E-01    0.708172E-02
 -------------------------------------------------------------------------------
 mylbfgs> Not resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6026724        0.1468913257E-02 after      0 steps
 mylbfgs> true and projected RMS:     0.1468913295E-02    0.1468913257E-02
 mylbfgs> Energy and RMS force=    -273.6027309        0.1279545213E-02 after      1 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1279551118E-02    0.1279545213E-02
 mylbfgs> Energy and RMS force=    -273.6027975        0.1324660416E-02 after      2 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1324709420E-02    0.1324660416E-02
 mylbfgs> Energy and RMS force=    -273.6028687        0.1382450851E-02 after      3 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1382618620E-02    0.1382450851E-02
 mylbfgs> Energy and RMS force=    -273.6029435        0.1402719471E-02 after      4 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1403134431E-02    0.1402719471E-02
 mylbfgs> Resetting LBFGS routine - step scaling factor was     0.8621812757E-01
 bfgsts> RMS grad=    0.1403134431E-02 subspace grad=    0.1402719471E-02 unscaled EF step length=    0.3555206288E-02

 BFGSTS> Beginning of optimization cycle   10.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.83321E-01   -0.83109E-01   -0.83533E-01  -273.602943744      -273.602943286      -273.602943474     0.426E-02
predicted gradient component=   -0.2287634970E-03
xmylbfgs> Eigenvalue and RMS=   -0.8310930561E-01    0.4256428681E-02 after      0 steps
 xmylbfgs> Turning off convergence after 0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.83369E-01   -0.83104E-01   -0.83634E-01  -273.602943744      -273.602943287      -273.602943474     0.422E-02
predicted gradient component=   -0.2285725031E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8310428663E-01   0.4221151533E-02   0.6039378958E-02 after      1 steps, step: 0.0000815273
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.83441E-01   -0.83297E-01   -0.83585E-01  -273.602943706      -273.602943325      -273.602943474     0.345E-02
predicted gradient component=   -0.1904345197E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8329725836E-01   0.3449606356E-02   0.2316663604     after      2 steps, step: 0.0149560129
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.83646E-01   -0.83386E-01   -0.83906E-01  -273.602943688      -273.602943343      -273.602943474     0.270E-02
predicted gradient component=   -0.1722609966E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8338580730E-01   0.2696100603E-02   0.1061918589     after      3 steps, step: 0.0083777146
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.83605E-01   -0.83442E-01   -0.83768E-01  -273.602943675      -273.602943356      -273.602943474     0.223E-02
predicted gradient component=   -0.1592645162E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8344234388E-01   0.2228429087E-02   0.6775526647E-01 after      4 steps, step: 0.0069150591
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.83653E-01   -0.83499E-01   -0.83807E-01  -273.602943658      -273.602943373      -273.602943474     0.151E-02
predicted gradient component=   -0.1422494904E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8349895894E-01   0.1511911247E-02   0.6780331419E-01 after      5 steps, step: 0.0141631704
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.83733E-01   -0.83512E-01   -0.83954E-01  -273.602943677      -273.602943354      -273.602943474     0.141E-02
predicted gradient component=   -0.1618114993E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8351220072E-01   0.1412897994E-02   0.1585610498E-01 after      6 steps, step: 0.0051413551
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.83631E-01   -0.83523E-01   -0.83739E-01  -273.602943686      -273.602943345      -273.602943474     0.866E-03
predicted gradient component=   -0.1707155093E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8352272062E-01   0.8655421948E-03   0.1259524962E-01 after      7 steps, step: 0.0015512639
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.83804E-01   -0.83534E-01   -0.84074E-01  -273.602943715      -273.602943316      -273.602943474     0.614E-03
predicted gradient component=   -0.1995279888E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8353357481E-01   0.6140685611E-03   0.1299380539E-01 after      8 steps, step: 0.0045542614
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.83833E-01   -0.83540E-01   -0.84126E-01  -273.602943740      -273.602943291      -273.602943474     0.577E-03
predicted gradient component=   -0.2246524957E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8354015719E-01   0.5771212645E-03   0.7879298534E-02 after      9 steps, step: 0.0042306161
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.83766E-01   -0.83539E-01   -0.83994E-01  -273.602943774      -273.602943257      -273.602943474     0.144E-02
predicted gradient component=   -0.2585360050E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8353850914E-01   0.1440503224E-02   0.1972800117E-02 after     10 steps, step: 0.0064691082
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.83784E-01   -0.83545E-01   -0.84023E-01  -273.602943766      -273.602943265      -273.602943474     0.310E-03
predicted gradient component=   -0.2509150079E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8354536230E-01   0.3103785139E-03   0.8202918764E-02 after     11 steps, step: 0.0018027619
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.83714E-01   -0.83548E-01   -0.83880E-01  -273.602943766      -273.602943265      -273.602943474     0.233E-03
predicted gradient component=   -0.2504050087E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8354797208E-01   0.2330382647E-03   0.3123697500E-02 after     12 steps, step: 0.0005820669
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.83705E-01   -0.83550E-01   -0.83860E-01  -273.602943771      -273.602943260      -273.602943474     0.191E-03
predicted gradient component=   -0.2551975058E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8354952799E-01   0.1912798107E-03   0.1862257055E-02 after     13 steps, step: 0.0019951295
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.83722E-01   -0.83550E-01   -0.83894E-01  -273.602943775      -273.602943256      -273.602943474     0.159E-03
predicted gradient component=   -0.2596109994E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8354992910E-01   0.1587182864E-03   0.4800868392E-03 after     14 steps, step: 0.0013614704
 xmylbfgs> Smallest eigenvalue converged in   14 steps. Eigenvalue=     -0.0835499 RMS force=      0.0001587 % change=    0.48009E-03
 xmylbfgs> Diagonal inverse Hessian elements are now         0.9872644471
beig> Overlap with previous vector=      0.9987209
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1   -0.259717E-03   -0.835499E-01 -0.310850E-02  0.300000E-01    0.658364E-02
 -------------------------------------------------------------------------------
 mylbfgs> Not resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6029431        0.1402695468E-02 after      0 steps
 mylbfgs> true and projected RMS:     0.1402695491E-02    0.1402695468E-02
 mylbfgs> Energy and RMS force=    -273.6029432        0.1402222035E-02 after      1 steps, step:  0.88540E-05
 mylbfgs> true and projected RMS:     0.1402222057E-02    0.1402222035E-02
 mylbfgs> Energy and RMS force=    -273.6030853        0.1118582164E-02 after      2 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1118582265E-02    0.1118582164E-02
 mylbfgs> Energy and RMS force=    -273.6031593        0.1978538994E-02 after      3 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1978540083E-02    0.1978538994E-02
 mylbfgs> Energy and RMS force=    -273.6032206        0.1206737576E-02 after      4 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1206750253E-02    0.1206737576E-02
 bfgsts> RMS grad=    0.1206750253E-02 subspace grad=    0.1206737576E-02 unscaled EF step length=    0.3108497347E-02

 BFGSTS> Beginning of optimization cycle   11.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.91670E-01   -0.91579E-01   -0.91761E-01  -273.603220727      -273.603220653      -273.603220644     0.330E-02
predicted gradient component=   -0.3700699835E-04
xmylbfgs> Eigenvalue and RMS=   -0.9157890629E-01    0.3296128614E-02 after      0 steps
 xmylbfgs> Turning off convergence after 0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.91712E-01   -0.91572E-01   -0.91852E-01  -273.603220727      -273.603220653      -273.603220644     0.328E-02
predicted gradient component=   -0.3700799311E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.9157160457E-01   0.3278796832E-02   0.7973779238E-02 after      1 steps, step: 0.0000488901
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.91723E-01   -0.91553E-01   -0.91893E-01  -273.603220707      -273.603220673      -273.603220644     0.548E-02
predicted gradient component=   -0.1714047926E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.9155321479E-01   0.5475099374E-02   0.2008643659E-01 after      2 steps, step: 0.0156676043
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.91738E-01   -0.91681E-01   -0.91795E-01  -273.603220708      -273.603220672      -273.603220644     0.123E-02
predicted gradient component=   -0.1830201768E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.9168090675E-01   0.1234465366E-02   0.1392786756     after      3 steps, step: 0.0070373268
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.91798E-01   -0.91692E-01   -0.91904E-01  -273.603220703      -273.603220678      -273.603220644     0.889E-03
predicted gradient component=   -0.1241500058E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.9169233742E-01   0.8889446414E-03   0.1246632974E-01 after      4 steps, step: 0.0018207490
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.91814E-01   -0.91712E-01   -0.91916E-01  -273.603220684      -273.603220696      -273.603220644     0.742E-03
predicted gradient component=    0.6366008165E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.9171242501E-01   0.7416339928E-03   0.2190280998E-01 after      5 steps, step: 0.0063654260
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.91805E-01   -0.91716E-01   -0.91894E-01  -273.603220668      -273.603220712      -273.603220644     0.116E-02
predicted gradient component=    0.2198549964E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.9171587516E-01   0.1155108950E-02   0.3761774270E-02 after      6 steps, step: 0.0042967569
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.92020E-01   -0.91720E-01   -0.92320E-01  -273.603220671      -273.603220710      -273.603220644     0.416E-03
predicted gradient component=    0.1952500384E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.9172043753E-01   0.4163576860E-03   0.4974211255E-02 after      7 steps, step: 0.0010587215
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.91906E-01   -0.91722E-01   -0.92090E-01  -273.603220671      -273.603220709      -273.603220644     0.322E-03
predicted gradient component=    0.1897799962E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.9172208775E-01   0.3221055754E-03   0.1799156110E-02 after      8 steps, step: 0.0009775764
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.91914E-01   -0.91724E-01   -0.92104E-01  -273.603220671      -273.603220710      -273.603220644     0.378E-03
predicted gradient component=    0.1941802452E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.9172436088E-01   0.3782319651E-03   0.2478213316E-02 after      9 steps, step: 0.0021878649
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.91890E-01   -0.91726E-01   -0.92054E-01  -273.603220668      -273.603220712      -273.603220644     0.314E-03
predicted gradient component=    0.2198800075E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.9172603864E-01   0.3136369537E-03   0.1829106335E-02 after     10 steps, step: 0.0024180977
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.91931E-01   -0.91726E-01   -0.92136E-01  -273.603220667      -273.603220713      -273.603220644     0.498E-03
predicted gradient component=    0.2283348977E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.9172598590E-01   0.4980482125E-03   0.5749688098E-04 after     11 steps, step: 0.0023145896
 xmylbfgs> Smallest eigenvalue converged in   11 steps. Eigenvalue=     -0.0917260 RMS force=      0.0004980 % change=    0.57497E-04
 xmylbfgs> Diagonal inverse Hessian elements are now         0.4914209802
beig> Overlap with previous vector=      0.9997142
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1    0.227404E-04   -0.917260E-01  0.247917E-03  0.300000E-01    0.181705E-02
 -------------------------------------------------------------------------------
 mylbfgs> Not resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6032206        0.1206708407E-02 after      0 steps
 mylbfgs> true and projected RMS:     0.1206708407E-02    0.1206708407E-02
 mylbfgs> Energy and RMS force=    -273.6032696        0.1117550924E-02 after      1 steps, step:  0.17133E-01
 mylbfgs> true and projected RMS:     0.1117550958E-02    0.1117550924E-02
 mylbfgs> Energy and RMS force=    -273.6033342        0.1195898208E-02 after      2 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1195898298E-02    0.1195898208E-02
 mylbfgs> Energy and RMS force=    -273.6034032        0.1265616238E-02 after      3 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1265616915E-02    0.1265616238E-02
 mylbfgs> Energy and RMS force=    -273.6034736        0.1359231560E-02 after      4 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1359234326E-02    0.1359231560E-02
 mylbfgs> Resetting LBFGS routine - step scaling factor was     0.6054236207E-01
 bfgsts> RMS grad=    0.1359234326E-02 subspace grad=    0.1359231560E-02 unscaled EF step length=    0.2479165362E-03

 BFGSTS> Beginning of optimization cycle   12.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.91680E-01   -0.91564E-01   -0.91796E-01  -273.603473629      -273.603473592      -273.603473564     0.329E-02
predicted gradient component=   -0.1837599939E-04
xmylbfgs> Eigenvalue and RMS=   -0.9156377537E-01    0.3288565741E-02 after      0 steps
 xmylbfgs> Turning off convergence after 0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.91816E-01   -0.91557E-01   -0.92075E-01  -273.603473629      -273.603473592      -273.603473564     0.326E-02
predicted gradient component=   -0.1848297870E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.9155669298E-01   0.3261101378E-02   0.7735519807E-02 after      1 steps, step: 0.0000486660
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.91787E-01   -0.91592E-01   -0.91982E-01  -273.603473643      -273.603473578      -273.603473564     0.311E-02
predicted gradient component=   -0.3236149837E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.9159239211E-01   0.3106406924E-02   0.3897608211E-01 after      2 steps, step: 0.0086377578
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.91822E-01   -0.91629E-01   -0.92015E-01  -273.603473642      -273.603473579      -273.603473564     0.904E-03
predicted gradient component=   -0.3153201078E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.9162858071E-01   0.9035361447E-03   0.3949487663E-01 after      3 steps, step: 0.0031502389
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.91823E-01   -0.91635E-01   -0.92010E-01  -273.603473644      -273.603473576      -273.603473564     0.733E-03
predicted gradient component=   -0.3413950367E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.9163536578E-01   0.7327392830E-03   0.7404425429E-02 after      4 steps, step: 0.0013791067
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.91832E-01   -0.91650E-01   -0.92014E-01  -273.603473657      -273.603473563      -273.603473564     0.805E-03
predicted gradient component=   -0.4689400157E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.9165040055E-01   0.8049844430E-03   0.1640448396E-01 after      5 steps, step: 0.0054124470
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.91868E-01   -0.91654E-01   -0.92082E-01  -273.603473668      -273.603473553      -273.603473564     0.109E-02
predicted gradient component=   -0.5748199783E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.9165382815E-01   0.1093495197E-02   0.3739724098E-02 after      6 steps, step: 0.0041747757
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.91850E-01   -0.91658E-01   -0.92042E-01  -273.603473670      -273.603473551      -273.603473564     0.357E-03
predicted gradient component=   -0.5958699489E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.9165783846E-01   0.3565788227E-03   0.4375297623E-02 after      7 steps, step: 0.0009949827
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.91856E-01   -0.91659E-01   -0.92053E-01  -273.603473672      -273.603473549      -273.603473564     0.257E-03
predicted gradient component=   -0.6169398148E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.9165905968E-01   0.2569780977E-03   0.1332351555E-02 after      8 steps, step: 0.0007606280
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.91835E-01   -0.91660E-01   -0.92010E-01  -273.603473676      -273.603473545      -273.603473564     0.317E-03
predicted gradient component=   -0.6550851595E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.9166030453E-01   0.3165914558E-03   0.1358120623E-02 after      9 steps, step: 0.0013506528
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.91764E-01   -0.91662E-01   -0.91867E-01  -273.603473682      -273.603473539      -273.603473564     0.257E-03
predicted gradient component=   -0.7118600820E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.9166155830E-01   0.2568235972E-03   0.1367815329E-02 after     10 steps, step: 0.0020178058
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.91868E-01   -0.91661E-01   -0.92075E-01  -273.603473687      -273.603473534      -273.603473564     0.704E-03
predicted gradient component=   -0.7615497566E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.9166090458E-01   0.7036955041E-03   0.7131946969E-03 after     11 steps, step: 0.0024180548
 xmylbfgs> Smallest eigenvalue converged in   11 steps. Eigenvalue=     -0.0916609 RMS force=      0.0007037 % change=    0.71319E-03
 xmylbfgs> Diagonal inverse Hessian elements are now         1.1334429773
beig> Overlap with previous vector=      0.9998085
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1   -0.761642E-04   -0.916609E-01 -0.830934E-03  0.300000E-01    0.150422E-02
 -------------------------------------------------------------------------------
 mylbfgs> Not resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6034735        0.1359119807E-02 after      0 steps
 mylbfgs> true and projected RMS:     0.1359119808E-02    0.1359119807E-02
 mylbfgs> Energy and RMS force=    -273.6034736        0.1358028230E-02 after      1 steps, step:  0.83124E-05
 mylbfgs> true and projected RMS:     0.1358028230E-02    0.1358028230E-02
 mylbfgs> Energy and RMS force=    -273.6035786        0.1393365766E-02 after      2 steps, step:  0.18085E-01
 mylbfgs> true and projected RMS:     0.1393373586E-02    0.1393365766E-02
 mylbfgs> Energy and RMS force=    -273.6036404        0.1138566272E-02 after      3 steps, step:  0.17895E-01
 mylbfgs> true and projected RMS:     0.1138664459E-02    0.1138566272E-02
 mylbfgs> Energy and RMS force=    -273.6036771        0.2022423177E-02 after      4 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.2022580657E-02    0.2022423177E-02
 bfgsts> RMS grad=    0.2022580657E-02 subspace grad=    0.2022423177E-02 unscaled EF step length=    0.8309341451E-03

 BFGSTS> Beginning of optimization cycle   13.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.83894E-01   -0.83704E-01   -0.84084E-01  -273.603677290      -273.603676952      -273.603677079     0.388E-02
predicted gradient component=   -0.1692609999E-03
xmylbfgs> Eigenvalue and RMS=   -0.8370381853E-01    0.3881820679E-02 after      0 steps
 xmylbfgs> Turning off convergence after 0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.83962E-01   -0.83698E-01   -0.84226E-01  -273.603677290      -273.603676952      -273.603677079     0.385E-02
predicted gradient component=   -0.1692210105E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8369792690E-01   0.3846954111E-02   0.7039158767E-02 after      1 steps, step: 0.0000678084
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.84065E-01   -0.83850E-01   -0.84280E-01  -273.603677283      -273.603676959      -273.603677079     0.251E-02
predicted gradient component=   -0.1616894849E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8385002794E-01   0.2511431584E-02   0.1813965375     after      2 steps, step: 0.0111493851
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.84121E-01   -0.83912E-01   -0.84331E-01  -273.603677280      -273.603676962      -273.603677079     0.228E-02
predicted gradient component=   -0.1591645002E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8391161873E-01   0.2277120907E-02   0.7339959935E-01 after      3 steps, step: 0.0081017057
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.84127E-01   -0.83949E-01   -0.84305E-01  -273.603677277      -273.603676965      -273.603677079     0.172E-02
predicted gradient component=   -0.1561244858E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8394904456E-01   0.1716019441E-02   0.4458160065E-01 after      4 steps, step: 0.0059277146
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.84216E-01   -0.83979E-01   -0.84453E-01  -273.603677278      -273.603676964      -273.603677079     0.912E-03
predicted gradient component=   -0.1568370180E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8397867404E-01   0.9118741177E-03   0.3528214995E-01 after      5 steps, step: 0.0085281277
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.84276E-01   -0.83989E-01   -0.84564E-01  -273.603677294      -273.603676948      -273.603677079     0.860E-03
predicted gradient component=   -0.1731989983E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8398851596E-01   0.8598200068E-03   0.1171816423E-01 after      6 steps, step: 0.0032171850
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.84249E-01   -0.83998E-01   -0.84500E-01  -273.603677307      -273.603676935      -273.603677079     0.790E-03
predicted gradient component=   -0.1861544945E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8399780633E-01   0.7895973499E-03   0.1106026341E-01 after      7 steps, step: 0.0034558457
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.84261E-01   -0.84005E-01   -0.84517E-01  -273.603677344      -273.603676898      -273.603677079     0.129E-02
predicted gradient component=   -0.2231405176E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8400531775E-01   0.1292715242E-02   0.8941597541E-02 after      8 steps, step: 0.0087526805
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.84385E-01   -0.84010E-01   -0.84760E-01  -273.603677356      -273.603676886      -273.603677079     0.795E-03
predicted gradient component=   -0.2348525072E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8401008508E-01   0.7949106273E-03   0.5674712174E-02 after      9 steps, step: 0.0025199032
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.84246E-01   -0.84012E-01   -0.84480E-01  -273.603677346      -273.603676896      -273.603677079     0.285E-03
predicted gradient component=   -0.2248279998E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8401238873E-01   0.2848423575E-03   0.2742028259E-02 after     10 steps, step: 0.0015671037
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.84398E-01   -0.84013E-01   -0.84783E-01  -273.603677346      -273.603676896      -273.603677079     0.208E-03
predicted gradient component=   -0.2246050030E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8401316171E-01   0.2084058686E-03   0.9200742000E-03 after     11 steps, step: 0.0005811352
 xmylbfgs> Smallest eigenvalue converged in   11 steps. Eigenvalue=     -0.0840132 RMS force=      0.0002084 % change=    0.92007E-03
 xmylbfgs> Diagonal inverse Hessian elements are now         0.1813597703
beig> Overlap with previous vector=      0.9992500
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1   -0.224708E-03   -0.840132E-01 -0.267465E-02  0.300000E-01    0.551201E-02
 -------------------------------------------------------------------------------
 mylbfgs> Not resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6036768        0.2022217133E-02 after      0 steps
 mylbfgs> true and projected RMS:     0.2022217141E-02    0.2022217133E-02
 mylbfgs> Energy and RMS force=    -273.6037310        0.1356850286E-02 after      1 steps, step:  0.15675E-01
 mylbfgs> true and projected RMS:     0.1356851465E-02    0.1356850286E-02
 mylbfgs> Energy and RMS force=    -273.6037940        0.1333878996E-02 after      2 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1333892107E-02    0.1333878996E-02
 mylbfgs> Energy and RMS force=    -273.6038555        0.1469538859E-02 after      3 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1469590184E-02    0.1469538859E-02
 mylbfgs> Energy and RMS force=    -273.6039167        0.1539020338E-02 after      4 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1539157723E-02    0.1539020338E-02
 bfgsts> RMS grad=    0.1539157723E-02 subspace grad=    0.1539020338E-02 unscaled EF step length=    0.2674654848E-02

 BFGSTS> Beginning of optimization cycle   14.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.81081E-01   -0.80947E-01   -0.81215E-01  -273.603916839      -273.603916563      -273.603916661     0.383E-02
predicted gradient component=   -0.1379885077E-03
xmylbfgs> Eigenvalue and RMS=   -0.8094683812E-01    0.3827397701E-02 after      0 steps
 xmylbfgs> Turning off convergence after 0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.81056E-01   -0.80941E-01   -0.81171E-01  -273.603916840      -273.603916563      -273.603916661     0.380E-02
predicted gradient component=   -0.1381110053E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8094107480E-01   0.3800102357E-02   0.7120393919E-02 after      1 steps, step: 0.0000659204
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.81413E-01   -0.81084E-01   -0.81742E-01  -273.603916849      -273.603916554      -273.603916661     0.358E-02
predicted gradient component=   -0.1471194935E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8108401721E-01   0.3583588408E-02   0.1762892584     after      2 steps, step: 0.0142198154
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.81331E-01   -0.81160E-01   -0.81502E-01  -273.603916843      -273.603916560      -273.603916661     0.224E-02
predicted gradient component=   -0.1415654935E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8116009179E-01   0.2241463677E-02   0.9373398101E-01 after      3 steps, step: 0.0063977750
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.81399E-01   -0.81202E-01   -0.81596E-01  -273.603916833      -273.603916570      -273.603916661     0.188E-02
predicted gradient component=   -0.1312764937E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8120167654E-01   0.1880441801E-02   0.5121168780E-01 after      4 steps, step: 0.0054493317
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.81534E-01   -0.81245E-01   -0.81823E-01  -273.603916822      -273.603916581      -273.603916661     0.146E-02
predicted gradient component=   -0.1206560114E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8124540195E-01   0.1457600252E-02   0.5381893234E-01 after      5 steps, step: 0.0116148559
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.81466E-01   -0.81252E-01   -0.81680E-01  -273.603916812      -273.603916592      -273.603916661     0.174E-02
predicted gradient component=   -0.1100639793E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8125191693E-01   0.1740060965E-02   0.8018247379E-02 after      6 steps, step: 0.0059032978
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.81573E-01   -0.81262E-01   -0.81884E-01  -273.603916821      -273.603916582      -273.603916661     0.657E-03
predicted gradient component=   -0.1191845058E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8126164133E-01   0.6572112813E-03   0.1196677763E-01 after      7 steps, step: 0.0018242537
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.81504E-01   -0.81266E-01   -0.81742E-01  -273.603916828      -273.603916576      -273.603916661     0.482E-03
predicted gradient component=   -0.1258889881E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8126592887E-01   0.4824593514E-03   0.5275939472E-02 after      8 steps, step: 0.0013645769
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.81595E-01   -0.81273E-01   -0.81917E-01  -273.603916843      -273.603916561      -273.603916661     0.577E-03
predicted gradient component=   -0.1408984929E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8127284217E-01   0.5769155335E-03   0.8506278571E-02 after      9 steps, step: 0.0040260514
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.81486E-01   -0.81278E-01   -0.81695E-01  -273.603916855      -273.603916548      -273.603916661     0.487E-03
predicted gradient component=   -0.1537690082E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8127762465E-01   0.4869404669E-03   0.5884128328E-02 after     10 steps, step: 0.0040839129
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.81564E-01   -0.81275E-01   -0.81853E-01  -273.603916876      -273.603916528      -273.603916661     0.128E-02
predicted gradient component=   -0.1740489779E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8127506045E-01   0.1275745354E-02   0.3154953855E-02 after     11 steps, step: 0.0057586567
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.81595E-01   -0.81281E-01   -0.81909E-01  -273.603916867      -273.603916537      -273.603916661     0.195E-03
predicted gradient component=   -0.1649114836E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8128080256E-01   0.1952657036E-03   0.7064525205E-02 after     12 steps, step: 0.0023148795
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.81536E-01   -0.81281E-01   -0.81791E-01  -273.603916866      -273.603916537      -273.603916661     0.160E-03
predicted gradient component=   -0.1647709951E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8128086145E-01   0.1604118742E-03   0.7245703098E-04 after     13 steps, step: 0.0003837715
 xmylbfgs> Smallest eigenvalue converged in   13 steps. Eigenvalue=     -0.0812809 RMS force=      0.0001604 % change=    0.72457E-04
 xmylbfgs> Diagonal inverse Hessian elements are now         0.1476421957
beig> Overlap with previous vector=      0.9991076
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1   -0.164737E-03   -0.812809E-01 -0.202676E-02  0.300000E-01    0.382398E-02
 -------------------------------------------------------------------------------
 mylbfgs> Not resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6039165        0.1538946800E-02 after      0 steps
 mylbfgs> true and projected RMS:     0.1538946803E-02    0.1538946800E-02
 mylbfgs> Energy and RMS force=    -273.6039757        0.1650268802E-02 after      1 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1650269359E-02    0.1650268802E-02
 mylbfgs> Resetting LBFGS routine - step scaling factor was     0.7188372330E-01
 mylbfgs> Energy and RMS force=    -273.6039759        0.1646394755E-02 after      2 steps, step:  0.12255E-04
 mylbfgs> true and projected RMS:     0.1646395313E-02    0.1646394755E-02
 mylbfgs> Energy and RMS force=    -273.6040223        0.1012685656E-02 after      3 steps, step:  0.73980E-02
 mylbfgs> true and projected RMS:     0.1012686619E-02    0.1012685656E-02
 mylbfgs> Energy and RMS force=    -273.6040429        0.1185493407E-02 after      4 steps, step:  0.50199E-02
 mylbfgs> true and projected RMS:     0.1185494058E-02    0.1185493407E-02
 bfgsts> RMS grad=    0.1185494058E-02 subspace grad=    0.1185493407E-02 unscaled EF step length=    0.2026756831E-02

 BFGSTS> Beginning of optimization cycle   15.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.83231E-01   -0.83114E-01   -0.83348E-01  -273.604042986      -273.604042969      -273.604042936     0.125E-02
predicted gradient component=   -0.8202505342E-05
xmylbfgs> Eigenvalue and RMS=   -0.8311366608E-01    0.1254594854E-02 after      0 steps
 xmylbfgs> Turning off convergence after 0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.83231E-01   -0.83106E-01   -0.83356E-01  -273.604042986      -273.604042969      -273.604042936     0.125E-02
predicted gradient component=   -0.8227488024E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.8310616283E-01   0.1248766725E-02   0.9028509662E-02 after      1 steps, step: 0.0000070830
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.83231E-01   -0.83118E-01   -0.83344E-01  -273.604042986      -273.604042969      -273.604042936     0.952E-03
predicted gradient component=   -0.8332506241E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.8311759136E-01   0.9515649178E-03   0.1374983705E-01 after      2 steps, step: 0.0028606512
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.83287E-01   -0.83124E-01   -0.83450E-01  -273.604042988      -273.604042967      -273.604042936     0.628E-03
predicted gradient component=   -0.1069449240E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.8312395475E-01   0.6281321003E-03   0.7655300274E-02 after      3 steps, step: 0.0016036113
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.83354E-01   -0.83132E-01   -0.83576E-01  -273.604042991      -273.604042964      -273.604042936     0.421E-03
predicted gradient component=   -0.1326600341E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.8313179454E-01   0.4208597821E-03   0.9430557162E-02 after      4 steps, step: 0.0039838729
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.83240E-01   -0.83135E-01   -0.83345E-01  -273.604042992      -273.604042963      -273.604042936     0.654E-03
predicted gradient component=   -0.1424299967E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.8313530129E-01   0.6542791665E-03   0.4218115720E-02 after      5 steps, step: 0.0028499972
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.83370E-01   -0.83137E-01   -0.83603E-01  -273.604042995      -273.604042960      -273.604042936     0.285E-03
predicted gradient component=   -0.1757300083E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.8313672215E-01   0.2846654986E-03   0.1709066019E-02 after      6 steps, step: 0.0019710413
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.83314E-01   -0.83139E-01   -0.83489E-01  -273.604042997      -273.604042958      -273.604042936     0.248E-03
predicted gradient component=   -0.1917200620E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.8313861120E-01   0.2481612192E-03   0.2272171039E-02 after      7 steps, step: 0.0007856311
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.83277E-01   -0.83140E-01   -0.83414E-01  -273.604043001      -273.604042954      -273.604042936     0.245E-03
predicted gradient component=   -0.2390450504E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.8313986605E-01   0.2451907419E-03   0.1509331392E-02 after      8 steps, step: 0.0020665550
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.83285E-01   -0.83139E-01   -0.83431E-01  -273.604043008      -273.604042947      -273.604042936     0.717E-03
predicted gradient component=   -0.3072551635E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.8313902348E-01   0.7174648751E-03   0.1013454045E-02 after      9 steps, step: 0.0023379429
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.83277E-01   -0.83140E-01   -0.83413E-01  -273.604043005      -273.604042950      -273.604042936     0.114E-03
predicted gradient component=   -0.2779549391E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.8314047150E-01   0.1143429661E-03   0.1741658090E-02 after     10 steps, step: 0.0010742682
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.83338E-01   -0.83141E-01   -0.83535E-01  -273.604043006      -273.604042949      -273.604042936     0.887E-04
predicted gradient component=   -0.2813501965E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.8314060956E-01   0.8870665968E-04   0.1660558985E-03 after     11 steps, step: 0.0001609658
 xmylbfgs> Smallest eigenvalue converged in   11 steps. Eigenvalue=     -0.0831406 RMS force=      0.0000887 % change=    0.16606E-03
 xmylbfgs> Diagonal inverse Hessian elements are now         0.1449864151
beig> Overlap with previous vector=      0.9999066
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1   -0.282279E-04   -0.831406E-01 -0.339519E-03  0.300000E-01    0.319398E-03
 -------------------------------------------------------------------------------
 mylbfgs> Not resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6040429        0.1185480266E-02 after      0 steps
 mylbfgs> true and projected RMS:     0.1185480266E-02    0.1185480266E-02
 mylbfgs> Energy and RMS force=    -273.6041070        0.1324007629E-02 after      1 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1324008172E-02    0.1324007629E-02
 mylbfgs> Energy and RMS force=    -273.6041470        0.1666651556E-02 after      2 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1666651556E-02    0.1666651556E-02
 mylbfgs> Energy and RMS force=    -273.6041928        0.1163026107E-02 after      3 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1163026108E-02    0.1163026107E-02
 mylbfgs> Energy and RMS force=    -273.6042371        0.1070454488E-02 after      4 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1070454507E-02    0.1070454488E-02
 mylbfgs> Energy and RMS force=    -273.6042812        0.1246375289E-02 after      5 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1246375559E-02    0.1246375289E-02
 mylbfgs> Energy and RMS force=    -273.6043255        0.1360567640E-02 after      6 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1360567649E-02    0.1360567640E-02
 mylbfgs> Energy and RMS force=    -273.6043691        0.1400127607E-02 after      7 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1400127653E-02    0.1400127607E-02
 mylbfgs> Energy and RMS force=    -273.6044125        0.1448162996E-02 after      8 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1448167280E-02    0.1448162996E-02
 mylbfgs> Energy and RMS force=    -273.6044558        0.1431279103E-02 after      9 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1431295953E-02    0.1431279103E-02
 mylbfgs> Energy and RMS force=    -273.6044982        0.1443869448E-02 after     10 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1443919632E-02    0.1443869448E-02
 mylbfgs> Resetting LBFGS routine - step scaling factor was     0.6718168701E-01
 bfgsts> RMS grad=    0.1443919632E-02 subspace grad=    0.1443869448E-02 unscaled EF step length=    0.3395193984E-03

 BFGSTS> Beginning of optimization cycle   16.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.81475E-01   -0.81112E-01   -0.81838E-01  -273.604498282      -273.604498120      -273.604498160     0.883E-02
predicted gradient component=   -0.8075249980E-04
xmylbfgs> Eigenvalue and RMS=   -0.8111215886E-01    0.8830381780E-02 after      0 steps
 xmylbfgs> Turning off convergence after 0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.81419E-01   -0.81125E-01   -0.81713E-01  -273.604498283      -273.604498119      -273.604498160     0.859E-02
predicted gradient component=   -0.8181348221E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.8112528259E-01   0.8587364213E-02   0.1617711836E-01 after      1 steps, step: 0.0003508904
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.81851E-01   -0.81564E-01   -0.82138E-01  -273.604498326      -273.604498076      -273.604498160     0.243E-02
predicted gradient component=   -0.1245575163E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8156427495E-01   0.2434697792E-02   0.5382164668     after      2 steps, step: 0.0149120058
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.81979E-01   -0.81615E-01   -0.82343E-01  -273.604498334      -273.604498068      -273.604498160     0.208E-02
predicted gradient component=   -0.1329945007E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8161537600E-01   0.2080710591E-02   0.6261204142E-01 after      3 steps, step: 0.0043833183
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.82075E-01   -0.81711E-01   -0.82439E-01  -273.604498365      -273.604498037      -273.604498160     0.197E-02
predicted gradient component=   -0.1639454865E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8171145565E-01   0.1967260914E-02   0.1175840607     after      4 steps, step: 0.0167396247
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.81910E-01   -0.81689E-01   -0.82131E-01  -273.604498390      -273.604498012      -273.604498160     0.422E-02
predicted gradient component=   -0.1892000228E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8168927663E-01   0.4220531153E-02   0.2715046998E-01 after      5 steps, step: 0.0101420936
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.82154E-01   -0.81742E-01   -0.82566E-01  -273.604498376      -273.604498027      -273.604498160     0.860E-03
predicted gradient component=   -0.1744029987E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8174184877E-01   0.8602966921E-03   0.6431484200E-01 after      6 steps, step: 0.0054629825
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.82075E-01   -0.81745E-01   -0.82404E-01  -273.604498377      -273.604498025      -273.604498160     0.668E-03
predicted gradient component=   -0.1761904969E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8174544915E-01   0.6679781828E-03   0.4404384223E-02 after      7 steps, step: 0.0010936890
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.82088E-01   -0.81763E-01   -0.82413E-01  -273.604498393      -273.604498009      -273.604498160     0.803E-03
predicted gradient component=   -0.1917260022E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8176306525E-01   0.8025900209E-03   0.2154530022E-01 after      8 steps, step: 0.0069653375
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.82041E-01   -0.81772E-01   -0.82310E-01  -273.604498403      -273.604497999      -273.604498160     0.595E-03
predicted gradient component=   -0.2023865022E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8177221338E-01   0.5949728345E-03   0.1118733363E-01 after      9 steps, step: 0.0047365045
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.82079E-01   -0.81773E-01   -0.82385E-01  -273.604498411      -273.604497991      -273.604498160     0.103E-02
predicted gradient component=   -0.2102514998E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.8177289979E-01   0.1032764665E-02   0.8394079393E-03 after     10 steps, step: 0.0062228921
 xmylbfgs> Smallest eigenvalue converged in   10 steps. Eigenvalue=     -0.0817729 RMS force=      0.0010328 % change=    0.83941E-03
 xmylbfgs> Diagonal inverse Hessian elements are now         0.9455461399
beig> Overlap with previous vector=      0.9989405
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1   -0.210378E-03   -0.817729E-01 -0.257270E-02  0.300000E-01    0.551777E-02
 -------------------------------------------------------------------------------
 mylbfgs> Not resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6044979        0.1443275792E-02 after      0 steps
 mylbfgs> true and projected RMS:     0.1443275803E-02    0.1443275792E-02
 mylbfgs> Energy and RMS force=    -273.6044980        0.1440405865E-02 after      1 steps, step:  0.93737E-05
 mylbfgs> true and projected RMS:     0.1440405875E-02    0.1440405865E-02
 mylbfgs> Energy and RMS force=    -273.6045350        0.8902166731E-03 after      2 steps, step:  0.67411E-02
 mylbfgs> true and projected RMS:     0.8902167157E-03    0.8902166731E-03
 mylbfgs> Energy and RMS force=    -273.6045517        0.1044712356E-02 after      3 steps, step:  0.45950E-02
 mylbfgs> true and projected RMS:     0.1044712684E-02    0.1044712356E-02
 mylbfgs> Energy and RMS force=    -273.6046062        0.1228038939E-02 after      4 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1228058484E-02    0.1228038939E-02
 bfgsts> RMS grad=    0.1228058484E-02 subspace grad=    0.1228038939E-02 unscaled EF step length=    0.2572697582E-02

 BFGSTS> Beginning of optimization cycle   17.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.81500E-01   -0.81354E-01   -0.81646E-01  -273.604606309      -273.604606217      -273.604606222     0.172E-02
predicted gradient component=   -0.4643601415E-04
xmylbfgs> Eigenvalue and RMS=   -0.8135449006E-01    0.1716455655E-02 after      0 steps
 xmylbfgs> Turning off convergence after 0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.81535E-01   -0.81354E-01   -0.81716E-01  -273.604606309      -273.604606217      -273.604606222     0.171E-02
predicted gradient component=   -0.4643948159E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.8135394376E-01   0.1709594639E-02   0.6715114153E-03 after      1 steps, step: 0.0000132580
 xmylbfgs> Smallest eigenvalue converged in    1 steps. Eigenvalue=     -0.0813539 RMS force=      0.0017096 % change=    0.67151E-03
 xmylbfgs> Diagonal inverse Hessian elements are now         0.1000000000
beig> Overlap with previous vector=      0.9999970
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1   -0.464785E-04   -0.813539E-01 -0.571312E-03  0.300000E-01    0.134027E-02
 -------------------------------------------------------------------------------
 mylbfgs> Not resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6046062        0.1228057799E-02 after      0 steps
 mylbfgs> true and projected RMS:     0.1228057799E-02    0.1228057799E-02
 mylbfgs> Energy and RMS force=    -273.6046060        0.2068127441E-02 after      1 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.2068166893E-02    0.2068127441E-02
 mylbfgs> Energy and RMS force=    -273.6046395        0.5658839473E-03 after      2 steps, step:  0.46417E-02
 mylbfgs> true and projected RMS:     0.5659830023E-03    0.5658839473E-03
 mylbfgs> Energy and RMS force=    -273.6046459        0.3778227792E-03 after      3 steps, step:  0.23852E-02
 mylbfgs> true and projected RMS:     0.3779654126E-03    0.3778227792E-03
 mylbfgs> Energy and RMS force=    -273.6046588        0.6881303326E-03 after      4 steps, step:  0.87546E-02
 mylbfgs> true and projected RMS:     0.6882361172E-03    0.6881303326E-03
 mylbfgs> Energy and RMS force=    -273.6046782        0.1105561703E-02 after      5 steps, step:  0.15922E-01
 mylbfgs> true and projected RMS:     0.1105683807E-02    0.1105561703E-02
 mylbfgs> Energy and RMS force=    -273.6047023        0.1376937212E-02 after      6 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1377137087E-02    0.1376937212E-02
 mylbfgs> Energy and RMS force=    -273.6047274        0.1474765223E-02 after      7 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1475120236E-02    0.1474765223E-02
 mylbfgs> Energy and RMS force=    -273.6047535        0.1449262115E-02 after      8 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1449872313E-02    0.1449262115E-02
 mylbfgs> Energy and RMS force=    -273.6047794        0.1467931429E-02 after      9 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1468920006E-02    0.1467931429E-02
 mylbfgs> Energy and RMS force=    -273.6048058        0.1355612086E-02 after     10 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1357221409E-02    0.1355612086E-02
 bfgsts> RMS grad=    0.1357221409E-02 subspace grad=    0.1355612086E-02 unscaled EF step length=    0.5713117362E-03

 BFGSTS> Beginning of optimization cycle   18.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.75396E-01   -0.74894E-01   -0.75898E-01  -273.604806277      -273.604805390      -273.604805796     0.812E-02
predicted gradient component=   -0.4432469893E-03
xmylbfgs> Eigenvalue and RMS=   -0.7489436083E-01    0.8124822247E-02 after      0 steps
 xmylbfgs> Turning off convergence after 0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.75595E-01   -0.74911E-01   -0.76279E-01  -273.604806278      -273.604805390      -273.604805796     0.797E-02
predicted gradient component=   -0.4441214969E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.7491100629E-01   0.7971796155E-02   0.2222031780E-01 after      1 steps, step: 0.0002970573
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.76150E-01   -0.75474E-01   -0.76826E-01  -273.604806322      -273.604805346      -273.604805796     0.305E-02
predicted gradient component=   -0.4882450071E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.7547371646E-01   0.3047052261E-02   0.7455710372     after      2 steps, step: 0.0200522788
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.76229E-01   -0.75595E-01   -0.76863E-01  -273.604806319      -273.604805349      -273.604805796     0.299E-02
predicted gradient component=   -0.4852994948E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.7559479472E-01   0.2990651703E-02   0.1601674538     after      3 steps, step: 0.0083097298
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.76513E-01   -0.75774E-01   -0.77252E-01  -273.604806303      -273.604805365      -273.604805796     0.493E-02
predicted gradient component=   -0.4690614901E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.7577383186E-01   0.4930549269E-02   0.2362783290     after      4 steps, step: 0.0354416545
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.76469E-01   -0.75829E-01   -0.77110E-01  -273.604806303      -273.604805365      -273.604805796     0.424E-02
predicted gradient component=   -0.4687755109E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.7582856643E-01   0.4241066806E-02   0.7218199347E-01 after      5 steps, step: 0.0118538503
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.76520E-01   -0.75888E-01   -0.77152E-01  -273.604806302      -273.604805367      -273.604805796     0.121E-02
predicted gradient component=   -0.4674909917E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.7588805304E-01   0.1209374326E-02   0.7838731887E-01 after      6 steps, step: 0.0076449176
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.76566E-01   -0.75901E-01   -0.77232E-01  -273.604806303      -273.604805365      -273.604805796     0.952E-03
predicted gradient component=   -0.4688109811E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.7590052474E-01   0.9519019625E-03   0.1643163286E-01 after      7 steps, step: 0.0018661964
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.76694E-01   -0.75940E-01   -0.77448E-01  -273.604806315      -273.604805354      -273.604805796     0.119E-02
predicted gradient component=   -0.4805510230E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.7593982620E-01   0.1190453507E-02   0.5175342842E-01 after      8 steps, step: 0.0103387175
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.76684E-01   -0.75959E-01   -0.77409E-01  -273.604806328      -273.604805340      -273.604805796     0.999E-03
predicted gradient component=   -0.4939630003E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.7595859212E-01   0.9989865475E-03   0.2470545802E-01 after      9 steps, step: 0.0084817091
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.76630E-01   -0.75926E-01   -0.77334E-01  -273.604806337      -273.604805331      -273.604805796     0.380E-02
predicted gradient component=   -0.5031150181E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.7592646254E-01   0.3803916563E-02   0.4231670556E-01 after     10 steps, step: 0.0135634197
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.76691E-01   -0.75971E-01   -0.77411E-01  -273.604806338      -273.604805330      -273.604805796     0.388E-03
predicted gradient component=   -0.5037504991E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.7597096906E-01   0.3882387089E-03   0.5858357919E-01 after     11 steps, step: 0.0065183264
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.76705E-01   -0.75972E-01   -0.77438E-01  -273.604806338      -273.604805330      -273.604805796     0.331E-03
predicted gradient component=   -0.5039065059E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.7597217608E-01   0.3308273084E-03   0.1588767848E-02 after     12 steps, step: 0.0006307339
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.76653E-01   -0.75976E-01   -0.77330E-01  -273.604806340      -273.604805328      -273.604805796     0.249E-03
predicted gradient component=   -0.5058284955E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.7597567323E-01   0.2490665000E-03   0.4602985523E-02 after     13 steps, step: 0.0031172024
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.76657E-01   -0.75976E-01   -0.77338E-01  -273.604806341      -273.604805327      -273.604805796     0.222E-03
predicted gradient component=   -0.5072264742E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.7597641948E-01   0.2224061258E-03   0.9822150299E-03 after     14 steps, step: 0.0016796968
 xmylbfgs> Smallest eigenvalue converged in   14 steps. Eigenvalue=     -0.0759764 RMS force=      0.0002224 % change=    0.98222E-03
 xmylbfgs> Diagonal inverse Hessian elements are now         1.1454134589
beig> Overlap with previous vector=      0.9971151
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1   -0.507257E-03   -0.759764E-01 -0.667621E-02  0.300000E-01    0.151732E-01
 -------------------------------------------------------------------------------
 mylbfgs> Not resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6048041        0.1355414692E-02 after      0 steps
 mylbfgs> true and projected RMS:     0.1355415181E-02    0.1355414692E-02
 mylbfgs> Energy and RMS force=    -273.6048285        0.1279012030E-02 after      1 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1279012037E-02    0.1279012030E-02
 mylbfgs> Energy and RMS force=    -273.6048521        0.1129153187E-02 after      2 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1129156525E-02    0.1129153187E-02
 mylbfgs> Energy and RMS force=    -273.6048743        0.9884353889E-03 after      3 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.9884555417E-03    0.9884353889E-03
 mylbfgs> Energy and RMS force=    -273.6048946        0.8358283308E-03 after      4 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.8359052571E-03    0.8358283308E-03
 bfgsts> RMS grad=    0.8359052571E-03 subspace grad=    0.8358283308E-03 unscaled EF step length=    0.6676205433E-02

 BFGSTS> Beginning of optimization cycle   19.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.76951E-01   -0.76504E-01   -0.77398E-01  -273.604894691      -273.604894539      -273.604894577     0.408E-02
predicted gradient component=   -0.7601050811E-04
xmylbfgs> Eigenvalue and RMS=   -0.7650385400E-01    0.4076593130E-02 after      0 steps
 xmylbfgs> Turning off convergence after 0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.77100E-01   -0.76507E-01   -0.77693E-01  -273.604894691      -273.604894539      -273.604894577     0.403E-02
predicted gradient component=   -0.7605299857E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.7650742041E-01   0.4029182772E-02   0.4661515226E-02 after      1 steps, step: 0.0000747838
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.77191E-01   -0.76625E-01   -0.77756E-01  -273.604894691      -273.604894540      -273.604894577     0.164E-02
predicted gradient component=   -0.7530749713E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.7662547376E-01   0.1640233503E-02   0.1540654136     after      2 steps, step: 0.0082140464
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.77136E-01   -0.76654E-01   -0.77618E-01  -273.604894690      -273.604894541      -273.604894577     0.154E-02
predicted gradient component=   -0.7473599339E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.7665396203E-01   0.1539331020E-02   0.3716477805E-01 after      3 steps, step: 0.0036688120
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.77175E-01   -0.76692E-01   -0.77658E-01  -273.604894685      -273.604894545      -273.604894577     0.221E-02
predicted gradient component=   -0.7002350344E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.7669183326E-01   0.2206082216E-02   0.4938103529E-01 after      4 steps, step: 0.0132046644
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.77269E-01   -0.76690E-01   -0.77848E-01  -273.604894683      -273.604894548      -273.604894577     0.259E-02
predicted gradient component=   -0.6764150839E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.7668995098E-01   0.2590926939E-02   0.2454398467E-02 after      5 steps, step: 0.0064597536
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.77349E-01   -0.76712E-01   -0.77986E-01  -273.604894685      -273.604894545      -273.604894577     0.551E-03
predicted gradient component=   -0.6992650015E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.7671194140E-01   0.5507366207E-03   0.2866623558E-01 after      6 steps, step: 0.0043270382
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.77275E-01   -0.76714E-01   -0.77836E-01  -273.604894686      -273.604894545      -273.604894577     0.455E-03
predicted gradient component=   -0.7037050409E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.7671398025E-01   0.4553815689E-03   0.2657723823E-02 after      7 steps, step: 0.0007505652
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.77349E-01   -0.76724E-01   -0.77974E-01  -273.604894687      -273.604894543      -273.604894577     0.592E-03
predicted gradient component=   -0.7210451258E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.7672413591E-01   0.5923264985E-03   0.1323659399E-01 after      8 steps, step: 0.0055572847
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.77234E-01   -0.76729E-01   -0.77739E-01  -273.604894688      -273.604894542      -273.604894577     0.435E-03
predicted gradient component=   -0.7299800586E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.7672864100E-01   0.4345608845E-03   0.5871454858E-02 after      9 steps, step: 0.0038329616
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.77344E-01   -0.76729E-01   -0.77959E-01  -273.604894693      -273.604894538      -273.604894577     0.750E-03
predicted gradient component=   -0.7718199413E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.7672863360E-01   0.7502007225E-03   0.9649456336E-05 after     10 steps, step: 0.0043567878
 xmylbfgs> Smallest eigenvalue converged in   10 steps. Eigenvalue=     -0.0767286 RMS force=      0.0007502 % change=    0.96495E-05
 xmylbfgs> Diagonal inverse Hessian elements are now         0.7598137015
beig> Overlap with previous vector=      0.9994677
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1   -0.772171E-04   -0.767286E-01 -0.100637E-02  0.300000E-01    0.443600E-02
 -------------------------------------------------------------------------------
 mylbfgs> Not resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6048945        0.8359271741E-03 after      0 steps
 mylbfgs> true and projected RMS:     0.8359271757E-03    0.8359271741E-03
 mylbfgs> Energy and RMS force=    -273.6049120        0.7096322302E-03 after      1 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.7096325582E-03    0.7096322302E-03
 mylbfgs> Energy and RMS force=    -273.6049272        0.5134235719E-03 after      2 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.5134308327E-03    0.5134235719E-03
 mylbfgs> Energy and RMS force=    -273.6049387        0.4200746839E-03 after      3 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.4201133944E-03    0.4200746839E-03
 mylbfgs> Energy and RMS force=    -273.6049468        0.2431209689E-03 after      4 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.2433162709E-03    0.2431209689E-03
 bfgsts> RMS grad=    0.2433162709E-03 subspace grad=    0.2431209689E-03 unscaled EF step length=    0.1006365710E-02

 BFGSTS> Beginning of optimization cycle   20.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.76709E-01   -0.76417E-01   -0.77001E-01  -273.604946877      -273.604946747      -273.604946774     0.403E-02
predicted gradient component=   -0.6530549967E-04
xmylbfgs> Eigenvalue and RMS=   -0.7641731555E-01    0.4026402673E-02 after      0 steps
 xmylbfgs> Turning off convergence after 0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.76837E-01   -0.76419E-01   -0.77254E-01  -273.604946877      -273.604946747      -273.604946774     0.398E-02
predicted gradient component=   -0.6542850883E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.7641941675E-01   0.3975125541E-02   0.2749572625E-02 after      1 steps, step: 0.0000729536
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.76985E-01   -0.76521E-01   -0.77449E-01  -273.604946876      -273.604946748      -273.604946774     0.147E-02
predicted gradient component=   -0.6418051157E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.7652122779E-01   0.1469970203E-02   0.1330493991     after      2 steps, step: 0.0070492144
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.76900E-01   -0.76541E-01   -0.77259E-01  -273.604946876      -273.604946748      -273.604946774     0.138E-02
predicted gradient component=   -0.6422499155E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.7654133737E-01   0.1375330103E-02   0.2627284118E-01 after      3 steps, step: 0.0029337422
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.77013E-01   -0.76578E-01   -0.77448E-01  -273.604946875      -273.604946749      -273.604946774     0.137E-02
predicted gradient component=   -0.6333351621E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.7657848039E-01   0.1365893595E-02   0.4850320440E-01 after      4 steps, step: 0.0107421704
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.76974E-01   -0.76561E-01   -0.77387E-01  -273.604946878      -273.604946746      -273.604946774     0.281E-02
predicted gradient component=   -0.6615601933E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.7656102890E-01   0.2811910176E-02   0.2279421336E-01 after      5 steps, step: 0.0073143260
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.76890E-01   -0.76590E-01   -0.77190E-01  -273.604946877      -273.604946748      -273.604946774     0.510E-03
predicted gradient component=   -0.6449698731E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.7659027141E-01   0.5100748027E-03   0.3818044006E-01 after      6 steps, step: 0.0042858565
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.77057E-01   -0.76592E-01   -0.77522E-01  -273.604946877      -273.604946748      -273.604946774     0.410E-03
predicted gradient component=   -0.6446248335E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.7659211519E-01   0.4096527598E-03   0.2407275344E-02 after      7 steps, step: 0.0007700561
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.76911E-01   -0.76600E-01   -0.77222E-01  -273.604946877      -273.604946747      -273.604946774     0.540E-03
predicted gradient component=   -0.6469448977E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.7660025661E-01   0.5399103904E-03   0.1062844862E-01 after      8 steps, step: 0.0055989232
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.76994E-01   -0.76601E-01   -0.77387E-01  -273.604946876      -273.604946748      -273.604946774     0.962E-03
predicted gradient component=   -0.6435701039E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.7660077141E-01   0.9621767911E-03   0.6720531789E-03 after      9 steps, step: 0.0037875160
 xmylbfgs> Smallest eigenvalue converged in    9 steps. Eigenvalue=     -0.0766008 RMS force=      0.0009622 % change=    0.67205E-03
 xmylbfgs> Diagonal inverse Hessian elements are now         0.6519659827
beig> Overlap with previous vector=      0.9996380
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1   -0.643147E-04   -0.766008E-01 -0.839608E-03  0.300000E-01    0.186499E-02
 -------------------------------------------------------------------------------
 mylbfgs> Not resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6049467        0.2429705342E-03 after      0 steps
 mylbfgs> true and projected RMS:     0.2429705349E-03    0.2429705342E-03
 mylbfgs> Energy and RMS force=    -273.6049506        0.3342477984E-03 after      1 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.3342515986E-03    0.3342477984E-03
 mylbfgs> Energy and RMS force=    -273.6049521        0.3235354711E-03 after      2 steps, step:  0.36030E-02
 mylbfgs> true and projected RMS:     0.3235387396E-03    0.3235354711E-03
 mylbfgs> Energy and RMS force=    -273.6049536        0.2357322739E-03 after      3 steps, step:  0.37581E-02
 mylbfgs> true and projected RMS:     0.2357349024E-03    0.2357322739E-03
 mylbfgs> Energy and RMS force=    -273.6049567        0.1247627999E-03 after      4 steps, step:  0.11385E-01
 mylbfgs> true and projected RMS:     0.1247634624E-03    0.1247627999E-03
 bfgsts> RMS grad=    0.1247634624E-03 subspace grad=    0.1247627999E-03 unscaled EF step length=    0.8396082651E-03

 BFGSTS> Beginning of optimization cycle   21.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.76982E-01   -0.77378E-01   -0.76586E-01  -273.604956723      -273.604956718      -273.604956682     0.123E-02
predicted gradient component=   -0.2720014436E-05
xmylbfgs> Eigenvalue and RMS=   -0.7737794009E-01    0.1229973442E-02 after      0 steps
 xmylbfgs> Turning off convergence after 0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.77174E-01   -0.77378E-01   -0.76970E-01  -273.604956724      -273.604956718      -273.604956682     0.122E-02
predicted gradient component=   -0.2801982646E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.7737837088E-01   0.1224925666E-02   0.5567339416E-03 after      1 steps, step: 0.0000068078
 xmylbfgs> Smallest eigenvalue converged in    1 steps. Eigenvalue=     -0.0773784 RMS force=      0.0012249 % change=    0.55673E-03
 xmylbfgs> Diagonal inverse Hessian elements are now         0.1000000000
beig> Overlap with previous vector=      0.9999997
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1   -0.272980E-05   -0.773784E-01 -0.352786E-04  0.300000E-01    0.626937E-03
 -------------------------------------------------------------------------------
 mylbfgs> Not resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6049567        0.1247618472E-03 after      0 steps
 mylbfgs> true and projected RMS:     0.1247618472E-03    0.1247618472E-03
 mylbfgs> Energy and RMS force=    -273.6049577        0.1321917598E-03 after      1 steps, step:  0.25297E-02
 mylbfgs> true and projected RMS:     0.1321917605E-03    0.1321917598E-03
 mylbfgs> Energy and RMS force=    -273.6049613        0.2938837085E-03 after      2 steps, step:  0.15678E-01
 mylbfgs> true and projected RMS:     0.2938840212E-03    0.2938837085E-03
 mylbfgs> Energy and RMS force=    -273.6049658        0.3298894355E-03 after      3 steps, step:  0.15732E-01
 mylbfgs> true and projected RMS:     0.3298902990E-03    0.3298894355E-03
 mylbfgs> Energy and RMS force=    -273.6049718        0.3545766109E-03 after      4 steps, step:  0.18319E-01
 mylbfgs> true and projected RMS:     0.3545801062E-03    0.3545766109E-03
 mylbfgs> Energy and RMS force=    -273.6049785        0.3872064382E-03 after      5 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.3872162713E-03    0.3872064382E-03
 mylbfgs> Energy and RMS force=    -273.6049857        0.3321759652E-03 after      6 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.3321947519E-03    0.3321759652E-03
 mylbfgs> Energy and RMS force=    -273.6049925        0.3278069975E-03 after      7 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.3278278697E-03    0.3278069975E-03
 mylbfgs> Energy and RMS force=    -273.6049989        0.2649662446E-03 after      8 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.2650002301E-03    0.2649662446E-03
 mylbfgs> Energy and RMS force=    -273.6050051        0.2363466542E-03 after      9 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.2363745042E-03    0.2363466542E-03
 mylbfgs> Energy and RMS force=    -273.6050107        0.2093715667E-03 after     10 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.2094065336E-03    0.2093715667E-03
 bfgsts> RMS grad=    0.2094065336E-03 subspace grad=    0.2093715667E-03 unscaled EF step length=    0.3527857317E-04

 BFGSTS> Beginning of optimization cycle   22.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.75361E-01   -0.75136E-01   -0.75586E-01  -273.605010749      -273.605010698      -273.605010686     0.929E-02
predicted gradient component=   -0.2559951895E-04
xmylbfgs> Eigenvalue and RMS=   -0.7513616601E-01    0.9294054385E-02 after      0 steps
 xmylbfgs> Turning off convergence after 0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.75265E-01   -0.75160E-01   -0.75370E-01  -273.605010749      -273.605010698      -273.605010686     0.895E-02
predicted gradient component=   -0.2557351308E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.7516023127E-01   0.8951491980E-02   0.3201861769E-01 after      1 steps, step: 0.0003887075
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.75601E-01   -0.75484E-01   -0.75719E-01  -273.605010748      -273.605010700      -273.605010686     0.128E-02
predicted gradient component=   -0.2405548116E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.7548360823E-01   0.1276739841E-02   0.4284068601     after      2 steps, step: 0.0106274155
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.75691E-01   -0.75494E-01   -0.75888E-01  -273.605010748      -273.605010700      -273.605010686     0.113E-02
predicted gradient component=   -0.2419449174E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.7549392484E-01   0.1128457062E-02   0.1366547787E-01 after      3 steps, step: 0.0015620580
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.75721E-01   -0.75540E-01   -0.75902E-01  -273.605010750      -273.605010698      -273.605010686     0.115E-02
predicted gradient component=   -0.2584147296E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.7553979277E-01   0.1151166017E-02   0.6072022200E-01 after      4 steps, step: 0.0118727209
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.75652E-01   -0.75498E-01   -0.75806E-01  -273.605010753      -273.605010695      -273.605010686     0.423E-02
predicted gradient component=   -0.2896300089E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.7549834655E-01   0.4227022654E-02   0.5489684668E-01 after      5 steps, step: 0.0092000326
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.75642E-01   -0.75550E-01   -0.75734E-01  -273.605010751      -273.605010697      -273.605010686     0.615E-03
predicted gradient component=   -0.2685698064E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.7555037251E-01   0.6149264600E-03   0.6886260974E-01 after      6 steps, step: 0.0056476052
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.75630E-01   -0.75552E-01   -0.75708E-01  -273.605010751      -273.605010697      -273.605010686     0.489E-03
predicted gradient component=   -0.2678498845E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.7555223546E-01   0.4889631747E-03   0.2465779915E-02 after      7 steps, step: 0.0008291925
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.75793E-01   -0.75562E-01   -0.76024E-01  -273.605010751      -273.605010697      -273.605010686     0.445E-03
predicted gradient component=   -0.2664251042E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.7556160622E-01   0.4447147596E-03   0.1240147988E-01 after      8 steps, step: 0.0060395188
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.75766E-01   -0.75566E-01   -0.75966E-01  -273.605010750      -273.605010698      -273.605010686     0.336E-03
predicted gradient component=   -0.2622900297E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.7556612028E-01   0.3364352703E-03   0.5973648449E-02 after      9 steps, step: 0.0034273131
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.75822E-01   -0.75566E-01   -0.76078E-01  -273.605010749      -273.605010699      -273.605010686     0.783E-03
predicted gradient component=   -0.2540102173E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.7556639758E-01   0.7827927896E-03   0.3669677797E-03 after     10 steps, step: 0.0040788908
 xmylbfgs> Smallest eigenvalue converged in   10 steps. Eigenvalue=     -0.0755664 RMS force=      0.0007828 % change=    0.36697E-03
 xmylbfgs> Diagonal inverse Hessian elements are now         1.4876738941
beig> Overlap with previous vector=      0.9995187
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1   -0.253784E-04   -0.755664E-01 -0.335842E-03  0.300000E-01    0.664644E-03
 -------------------------------------------------------------------------------
 mylbfgs> Not resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6050107        0.2093495314E-03 after      0 steps
 mylbfgs> true and projected RMS:     0.2093495315E-03    0.2093495314E-03
 mylbfgs> Energy and RMS force=    -273.6050159        0.1809849757E-03 after      1 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1809849760E-03    0.1809849757E-03
 mylbfgs> Energy and RMS force=    -273.6050205        0.1792908719E-03 after      2 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1792908740E-03    0.1792908719E-03
 mylbfgs> Energy and RMS force=    -273.6050242        0.1626210060E-03 after      3 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1626211725E-03    0.1626210060E-03
 mylbfgs> Energy and RMS force=    -273.6050274        0.1387810986E-03 after      4 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1387814149E-03    0.1387810986E-03
 bfgsts> RMS grad=    0.1387814149E-03 subspace grad=    0.1387810986E-03 unscaled EF step length=    0.3358420444E-03

 BFGSTS> Beginning of optimization cycle   23.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.75306E-01   -0.75188E-01   -0.75424E-01  -273.605027402      -273.605027406      -273.605027367     0.392E-02
predicted gradient component=    0.2017998213E-05
xmylbfgs> Eigenvalue and RMS=   -0.7518752098E-01    0.3919868972E-02 after      0 steps
 xmylbfgs> Turning off convergence after 0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.75465E-01   -0.75190E-01   -0.75740E-01  -273.605027402      -273.605027406      -273.605027367     0.386E-02
predicted gradient component=    0.1984517439E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.7519018621E-01   0.3859756822E-02   0.3544662141E-02 after      1 steps, step: 0.0000691442
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.75486E-01   -0.75252E-01   -0.75720E-01  -273.605027402      -273.605027407      -273.605027367     0.748E-03
predicted gradient component=    0.2330011739E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.7525164534E-01   0.7484285789E-03   0.8167147668E-01 after      2 steps, step: 0.0047628551
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.75422E-01   -0.75256E-01   -0.75588E-01  -273.605027402      -273.605027407      -273.605027367     0.673E-03
predicted gradient component=    0.2370001084E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.7525568883E-01   0.6734996932E-03   0.5372996200E-02 after      3 steps, step: 0.0009136937
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.75439E-01   -0.75267E-01   -0.75611E-01  -273.605027401      -273.605027408      -273.605027367     0.913E-03
predicted gradient component=    0.3502492518E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.7526684855E-01   0.9130266045E-03   0.1482687037E-01 after      4 steps, step: 0.0078690256
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.75440E-01   -0.75264E-01   -0.75616E-01  -273.605027400      -273.605027408      -273.605027367     0.139E-02
predicted gradient component=    0.3890988864E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.7526443198E-01   0.1390219120E-02   0.3210769028E-02 after      5 steps, step: 0.0024460370
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.75500E-01   -0.75271E-01   -0.75729E-01  -273.605027401      -273.605027408      -273.605027367     0.182E-03
predicted gradient component=    0.3444000640E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.7527104995E-01   0.1822348814E-03   0.8792184388E-02 after      6 steps, step: 0.0020126538
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.75523E-01   -0.75271E-01   -0.75775E-01  -273.605027401      -273.605027408      -273.605027367     0.155E-03
predicted gradient component=    0.3414498906E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.7527120634E-01   0.1553630443E-03   0.2077741861E-03 after      7 steps, step: 0.0002075069
 xmylbfgs> Smallest eigenvalue converged in    7 steps. Eigenvalue=     -0.0752712 RMS force=      0.0001554 % change=    0.20777E-03
 xmylbfgs> Diagonal inverse Hessian elements are now         0.1531871029
beig> Overlap with previous vector=      0.9999417
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1    0.346125E-05   -0.752712E-01  0.459837E-04  0.300000E-01    0.119020E-02
 -------------------------------------------------------------------------------
 mylbfgs> Not resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6050274        0.1387801002E-03 after      0 steps
 mylbfgs> true and projected RMS:     0.1387801002E-03    0.1387801002E-03
 mylbfgs> Energy and RMS force=    -273.6050288        0.1781996944E-03 after      1 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1781997765E-03    0.1781996944E-03
 mylbfgs> Energy and RMS force=    -273.6050301        0.1133728004E-03 after      2 steps, step:  0.56454E-02
 mylbfgs> true and projected RMS:     0.1133733246E-03    0.1133728004E-03
 mylbfgs> Energy and RMS force=    -273.6050308        0.9277696107E-04 after      3 steps, step:  0.63842E-02
 mylbfgs> true and projected RMS:     0.9277750422E-04    0.9277696107E-04
 mylbfgs> Energy and RMS force=    -273.6050315        0.9208683793E-04 after      4 steps, step:  0.50540E-02
 mylbfgs> true and projected RMS:     0.9208707821E-04    0.9208683793E-04
 mylbfgs> Energy and RMS force=    -273.6050322        0.8248737740E-04 after      5 steps, step:  0.38744E-02
 mylbfgs> true and projected RMS:     0.8248767081E-04    0.8248737740E-04
 mylbfgs> Energy and RMS force=    -273.6050329        0.6612591083E-04 after      6 steps, step:  0.46427E-02
 mylbfgs> true and projected RMS:     0.6612700618E-04    0.6612591083E-04
 mylbfgs> Energy and RMS force=    -273.6050336        0.7290384380E-04 after      7 steps, step:  0.57886E-02
 mylbfgs> true and projected RMS:     0.7290812567E-04    0.7290384380E-04
 mylbfgs> Energy and RMS force=    -273.6050339        0.5308589297E-04 after      8 steps, step:  0.52337E-02
 mylbfgs> true and projected RMS:     0.5309790212E-04    0.5308589297E-04
 mylbfgs> Energy and RMS force=    -273.6050341        0.3937131490E-04 after      9 steps, step:  0.17546E-02
 mylbfgs> true and projected RMS:     0.3939136067E-04    0.3937131490E-04
 mylbfgs> Energy and RMS force=    -273.6050343        0.3146766871E-04 after     10 steps, step:  0.22255E-02
 mylbfgs> true and projected RMS:     0.3149743491E-04    0.3146766871E-04
 bfgsts> RMS grad=    0.3149743491E-04 subspace grad=    0.3146766871E-04 unscaled EF step length=    0.4598371505E-04

 BFGSTS> Beginning of optimization cycle   24.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.75337E-01   -0.75527E-01   -0.75147E-01  -273.605034326      -273.605034345      -273.605034298     0.166E-02
predicted gradient component=    0.9193485084E-05
xmylbfgs> Eigenvalue and RMS=   -0.7552679219E-01    0.1661080451E-02 after      0 steps
 xmylbfgs> Turning off convergence after 0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.75541E-01   -0.75530E-01   -0.75552E-01  -273.605034326      -273.605034345      -273.605034298     0.165E-02
predicted gradient component=    0.9150483038E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.7552997929E-01   0.1650405040E-02   0.4219658307E-02 after      1 steps, step: 0.0000124163
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.75468E-01   -0.75540E-01   -0.75396E-01  -273.605034326      -273.605034345      -273.605034298     0.543E-03
predicted gradient component=    0.9280000768E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.7553987158E-01   0.5432203591E-03   0.1309544790E-01 after      2 steps, step: 0.0022532564
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.75458E-01   -0.75542E-01   -0.75374E-01  -273.605034326      -273.605034345      -273.605034298     0.303E-03
predicted gradient component=    0.9267978385E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.7554174742E-01   0.3031774959E-03   0.2483184638E-02 after      3 steps, step: 0.0005248303
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.75396E-01   -0.75542E-01   -0.75250E-01  -273.605034326      -273.605034345      -273.605034298     0.294E-03
predicted gradient component=    0.9347985497E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.7554227776E-01   0.2942227132E-03   0.7020522207E-03 after      4 steps, step: 0.0007146124
 xmylbfgs> Smallest eigenvalue converged in    4 steps. Eigenvalue=     -0.0755423 RMS force=      0.0002942 % change=    0.70205E-03
 xmylbfgs> Diagonal inverse Hessian elements are now         0.1537806170
beig> Overlap with previous vector=      0.9999963
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1    0.935079E-05   -0.755423E-01  0.123782E-03  0.300000E-01    0.594556E-03
 -------------------------------------------------------------------------------
 mylbfgs> Not resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6050343        0.3146401503E-04 after      0 steps
 mylbfgs> true and projected RMS:     0.3146401504E-04    0.3146401503E-04
 mylbfgs> Energy and RMS force=    -273.6050344        0.3845099802E-04 after      1 steps, step:  0.23677E-02
 mylbfgs> true and projected RMS:     0.3845101038E-04    0.3845099802E-04
 mylbfgs> Energy and RMS force=    -273.6050344        0.1178557173E-04 after      2 steps, step:  0.13669E-02
 mylbfgs> true and projected RMS:     0.1178558138E-04    0.1178557173E-04
 mylbfgs> Energy and RMS force=    -273.6050344        0.8461939476E-05 after      3 steps, step:  0.30905E-03
 mylbfgs> true and projected RMS:     0.8461940095E-05    0.8461939476E-05
 mylbfgs> Diagonal inverse Hessian elements are now         0.6674270201
 mylbfgs> Final energy is   -273.60503444104103    
 bfgsts> RMS grad=    0.8461940095E-05 subspace grad=    0.8461939476E-05 unscaled EF step length=    0.1237822137E-03
 Converged to TS (number of iterations):         24
 DNEB run yielded 1 true transition state(s) time=      2.13
 Energies:
  -273.60503444104103     

 >>>>>  Path run for ts 1 ...
 bfgsts> resetting maximum uphill step size to     0.2000000000E-01

 bfgsts> Stepping away from saddle along softest mode + direction
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1    0.000000E+00   -0.755423E-01  0.100000E+00  0.181818E-01    0.100000E+01
 -------------------------------------------------------------------------------
 golden> golden a, b, c, d=     0.000000000        0.1000000000        0.3819660113E-01    0.6180339887E-01 initially
 golden> energy at ts, C and D and diff=    -273.605034441041        -273.605086071103        -273.605163764026       -0.129322984946612E-03
 golden> energy at ts, C and D and diff=    -273.605034441041        -273.605163764058        -273.605226348789       -0.191907747989717E-03
 golden> energy at ts, C and D and diff=    -273.605034441041        -273.605226348694        -273.605269863705       -0.235422663990903E-03
 golden> energy at ts, C and D and diff=    -273.605034441041        -273.605269863718        -273.605298427181       -0.263986139998451E-03
 golden> energy at ts, C and D and diff=    -273.605034441041        -273.605298427075        -273.605316675538       -0.282234496978617E-03
 golden> energy at ts, C and D and diff=    -273.605034441041        -273.605316675382        -273.605328170896       -0.293729854945468E-03
 golden> energy at ts, C and D and diff=    -273.605034441041        -273.605328170752        -273.605335355794       -0.300914752983772E-03
 golden> energy at ts, C and D and diff=    -273.605034441041        -273.605335355748        -273.605339826597       -0.305385555975590E-03
 golden> energy at ts, C and D and diff=    -273.605034441041        -273.605339826475        -273.605342601161       -0.308160119971035E-03
 golden> energy at ts, C and D and diff=    -273.605034441041        -273.605342601124        -273.605344320107       -0.309879065980567E-03
 path> golden section + pushoff, energy, delta, step:     -273.605344320107       -0.309879065980567E-03    0.995934690628392E-01
 mylbfgs> Resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6053449        0.8695263538E-03 after      0 steps
 mylbfgs> Energy and RMS force=    -273.6053449        0.8694376353E-03 after      1 steps, step:  0.34023E-05
 mylbfgs> Energy and RMS force=    -273.6054595        0.1161221644E-02 after      2 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6055734        0.1783791508E-02 after      3 steps, step:  0.20000E-01
 mylbfgs> Resetting LBFGS routine - step scaling factor was     0.8327498322E-02
 mylbfgs> Energy and RMS force=    -273.6055735        0.1779576588E-02 after      4 steps, step:  0.14319E-04
 mylbfgs> Energy and RMS force=    -273.6056356        0.1178799460E-02 after      5 steps, step:  0.84009E-02
 mylbfgs> Energy and RMS force=    -273.6056767        0.1798921702E-02 after      6 steps, step:  0.83855E-02
 mylbfgs> Energy and RMS force=    -273.6057731        0.2900257412E-02 after      7 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6058715        0.3674476827E-02 after      8 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6059744        0.4231423451E-02 after      9 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6060809        0.4630684647E-02 after     10 steps, step:  0.20000E-01
 mylbfgs> Resetting LBFGS routine - step scaling factor was     0.8811274687E-01
 mylbfgs> Energy and RMS force=    -273.6060839        0.4592483452E-02 after     11 steps, step:  0.96495E-04
 mylbfgs> Energy and RMS force=    -273.6062915        0.1158770997E-02 after     12 steps, step:  0.12996E-01
 mylbfgs> Energy and RMS force=    -273.6063160        0.1212194529E-02 after     13 steps, step:  0.37362E-02
 mylbfgs> Energy and RMS force=    -273.6064326        0.1672180522E-02 after     14 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6065379        0.2036421932E-02 after     15 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6066380        0.2282857913E-02 after     16 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6067356        0.2338961234E-02 after     17 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6068278        0.2342630523E-02 after     18 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6069105        0.2369193662E-02 after     19 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6069898        0.2117870772E-02 after     20 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6070551        0.1998436039E-02 after     21 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6071121        0.1545009013E-02 after     22 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6071546        0.1014604502E-02 after     23 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6071801        0.5726165264E-03 after     24 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6071894        0.6219412134E-03 after     25 steps, step:  0.12144E-01
 mylbfgs> Energy and RMS force=    -273.6071958        0.5023630763E-03 after     26 steps, step:  0.35622E-02
 mylbfgs> Energy and RMS force=    -273.6072036        0.5565637179E-03 after     27 steps, step:  0.63186E-02
 mylbfgs> Energy and RMS force=    -273.6072150        0.6640612262E-03 after     28 steps, step:  0.11310E-01
 mylbfgs> Energy and RMS force=    -273.6072287        0.9305357011E-03 after     29 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6072486        0.6169072921E-03 after     30 steps, step:  0.17628E-01
 mylbfgs> Energy and RMS force=    -273.6072691        0.5229697540E-03 after     31 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6072874        0.6027319596E-03 after     32 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6073047        0.6351505376E-03 after     33 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6073213        0.7092579551E-03 after     34 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6073390        0.7800059467E-03 after     35 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6073577        0.8345784345E-03 after     36 steps, step:  0.20000E-01
 mylbfgs> Resetting LBFGS routine - step scaling factor was     0.7928594532E-01
 mylbfgs> Energy and RMS force=    -273.6073577        0.8339536057E-03 after     37 steps, step:  0.31343E-05
 mylbfgs> Energy and RMS force=    -273.6073798        0.6331025484E-03 after     38 steps, step:  0.64141E-02
 mylbfgs> Energy and RMS force=    -273.6073936        0.7911034563E-03 after     39 steps, step:  0.62436E-02
 mylbfgs> Energy and RMS force=    -273.6074167        0.1165882998E-02 after     40 steps, step:  0.16857E-01
 mylbfgs> Energy and RMS force=    -273.6074251        0.1356043452E-02 after     41 steps, step:  0.18068E-01
 mylbfgs> Energy and RMS force=    -273.6074399        0.4667701597E-03 after     42 steps, step:  0.47679E-02
 mylbfgs> Energy and RMS force=    -273.6074454        0.4061665007E-03 after     43 steps, step:  0.24977E-02
 mylbfgs> Energy and RMS force=    -273.6074533        0.5752524616E-03 after     44 steps, step:  0.61154E-02
 mylbfgs> Energy and RMS force=    -273.6074684        0.7596008871E-03 after     45 steps, step:  0.13776E-01
 mylbfgs> Energy and RMS force=    -273.6074871        0.1148224878E-02 after     46 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6075086        0.1100448482E-02 after     47 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6075322        0.1108721203E-02 after     48 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6075552        0.1178251732E-02 after     49 steps, step:  0.20000E-01
 mylbfgs> Resetting LBFGS routine - step scaling factor was     0.6721556979E-01
 mylbfgs> Energy and RMS force=    -273.6075553        0.1176470467E-02 after     50 steps, step:  0.62472E-05
 mylbfgs> Energy and RMS force=    -273.6075816        0.7049359161E-03 after     51 steps, step:  0.59684E-02
 mylbfgs> Energy and RMS force=    -273.6075912        0.6647960684E-03 after     52 steps, step:  0.36526E-02
 mylbfgs> Energy and RMS force=    -273.6076097        0.6824237090E-03 after     53 steps, step:  0.10452E-01
 mylbfgs> Energy and RMS force=    -273.6076167        0.1395776483E-02 after     54 steps, step:  0.15127E-01
 mylbfgs> Energy and RMS force=    -273.6076337        0.7085988327E-03 after     55 steps, step:  0.34409E-02
 mylbfgs> Energy and RMS force=    -273.6076540        0.7497534686E-03 after     56 steps, step:  0.10718E-01
 mylbfgs> Energy and RMS force=    -273.6076787        0.9953620438E-03 after     57 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6077030        0.1032185264E-02 after     58 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6077286        0.1081442131E-02 after     59 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6077551        0.1049903409E-02 after     60 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6077826        0.1051314186E-02 after     61 steps, step:  0.20000E-01
 mylbfgs> Resetting LBFGS routine - step scaling factor was     0.7027895319E-01
 mylbfgs> Energy and RMS force=    -273.6077826        0.1049729716E-02 after     62 steps, step:  0.49737E-05
 mylbfgs> Energy and RMS force=    -273.6078018        0.7593373005E-03 after     63 steps, step:  0.47528E-02
 mylbfgs> Energy and RMS force=    -273.6078117        0.9233296843E-03 after     64 steps, step:  0.34814E-02
 mylbfgs> Energy and RMS force=    -273.6078512        0.1188150451E-02 after     65 steps, step:  0.17815E-01
 mylbfgs> Energy and RMS force=    -273.6078860        0.1343914663E-02 after     66 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6079102        0.1257402064E-02 after     67 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6079319        0.6143386823E-03 after     68 steps, step:  0.13445E-01
 mylbfgs> Energy and RMS force=    -273.6079458        0.7660387550E-03 after     69 steps, step:  0.84556E-02
 mylbfgs> Energy and RMS force=    -273.6079683        0.1236771212E-02 after     70 steps, step:  0.15660E-01
 mylbfgs> Energy and RMS force=    -273.6079974        0.1527168000E-02 after     71 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6080287        0.1682067672E-02 after     72 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6080612        0.1789936983E-02 after     73 steps, step:  0.20000E-01
 mylbfgs> Resetting LBFGS routine - step scaling factor was     0.7517274713E-01
 mylbfgs> Energy and RMS force=    -273.6080614        0.1784350686E-02 after     74 steps, step:  0.14417E-04
 mylbfgs> Energy and RMS force=    -273.6080993        0.8920321488E-03 after     75 steps, step:  0.59743E-02
 mylbfgs> Energy and RMS force=    -273.6081104        0.9075696651E-03 after     76 steps, step:  0.28339E-02
 mylbfgs> Energy and RMS force=    -273.6081505        0.7709249232E-03 after     77 steps, step:  0.15424E-01
 mylbfgs> Energy and RMS force=    -273.6081657        0.1652389451E-02 after     78 steps, step:  0.17516E-01
 mylbfgs> Energy and RMS force=    -273.6081942        0.9484086301E-03 after     79 steps, step:  0.77658E-02
 mylbfgs> Energy and RMS force=    -273.6082361        0.9410300595E-03 after     80 steps, step:  0.19945E-01
 mylbfgs> Energy and RMS force=    -273.6082650        0.9627635461E-03 after     81 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6082945        0.1034533170E-02 after     82 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6083257        0.9240489811E-03 after     83 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6083575        0.8502815177E-03 after     84 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6083889        0.8988312757E-03 after     85 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6084219        0.8376470795E-03 after     86 steps, step:  0.20000E-01
 mylbfgs> Resetting LBFGS routine - step scaling factor was     0.8487131569E-01
 mylbfgs> Energy and RMS force=    -273.6084219        0.8372222206E-03 after     87 steps, step:  0.31574E-05
 mylbfgs> Energy and RMS force=    -273.6084600        0.1032375234E-02 after     88 steps, step:  0.10814E-01
 mylbfgs> Energy and RMS force=    -273.6084896        0.1218541592E-02 after     89 steps, step:  0.11068E-01
 mylbfgs> Energy and RMS force=    -273.6085400        0.1138262573E-02 after     90 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6085701        0.1383866518E-02 after     91 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6085998        0.5440889452E-03 after     92 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6086107        0.5266512056E-03 after     93 steps, step:  0.82954E-02
 mylbfgs> Energy and RMS force=    -273.6086282        0.7649705463E-03 after     94 steps, step:  0.14161E-01
 mylbfgs> Energy and RMS force=    -273.6086525        0.1076427946E-02 after     95 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6086815        0.1099384618E-02 after     96 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087110        0.1225886219E-02 after     97 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087427        0.1161731068E-02 after     98 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087735        0.1253222495E-02 after     99 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6088050        0.1159351859E-02 after    100 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6088352        0.1160601896E-02 after    101 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6088655        0.1041567845E-02 after    102 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6088933        0.1038558042E-02 after    103 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6089210        0.8863361580E-03 after    104 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6089463        0.8241150075E-03 after    105 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6089693        0.6329938116E-03 after    106 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6089898        0.4937846881E-03 after    107 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6090055        0.5289711462E-03 after    108 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6090185        0.2827271822E-03 after    109 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6090266        0.3249060460E-03 after    110 steps, step:  0.19447E-01
 mylbfgs> Energy and RMS force=    -273.6090282        0.5477799514E-03 after    111 steps, step:  0.10573E-01
 mylbfgs> Energy and RMS force=    -273.6090331        0.2590168534E-03 after    112 steps, step:  0.72425E-02
 mylbfgs> Energy and RMS force=    -273.6090366        0.1623796167E-03 after    113 steps, step:  0.73185E-02
 mylbfgs> Energy and RMS force=    -273.6090397        0.2072780653E-03 after    114 steps, step:  0.60952E-02
 mylbfgs> Energy and RMS force=    -273.6090456        0.3070731460E-03 after    115 steps, step:  0.12779E-01
 mylbfgs> Energy and RMS force=    -273.6090518        0.4227228623E-03 after    116 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6090588        0.3166438201E-03 after    117 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6090648        0.2224939190E-03 after    118 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6090690        0.2261610866E-03 after    119 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6090716        0.1594565935E-03 after    120 steps, step:  0.15538E-01
 mylbfgs> Energy and RMS force=    -273.6090731        0.1443058017E-03 after    121 steps, step:  0.30975E-02
 mylbfgs> Energy and RMS force=    -273.6090777        0.1812589022E-03 after    122 steps, step:  0.15037E-01
 mylbfgs> Energy and RMS force=    -273.6090817        0.2376793709E-03 after    123 steps, step:  0.13584E-01
 mylbfgs> Energy and RMS force=    -273.6090873        0.2340009913E-03 after    124 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6090929        0.2397927427E-03 after    125 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6090982        0.2082859990E-03 after    126 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091031        0.1752021325E-03 after    127 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091074        0.1609854224E-03 after    128 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091112        0.1479665186E-03 after    129 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091146        0.1284628859E-03 after    130 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091175        0.1574418556E-03 after    131 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091205        0.1237794952E-03 after    132 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091229        0.1204837498E-03 after    133 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091254        0.1666053126E-03 after    134 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091269        0.7657342008E-04 after    135 steps, step:  0.17426E-01
 mylbfgs> Energy and RMS force=    -273.6091276        0.1300476784E-03 after    136 steps, step:  0.10227E-01
 mylbfgs> Energy and RMS force=    -273.6091282        0.6930473496E-04 after    137 steps, step:  0.50383E-02
 mylbfgs> Energy and RMS force=    -273.6091284        0.4041688455E-04 after    138 steps, step:  0.62884E-02
 mylbfgs> Energy and RMS force=    -273.6091286        0.4501656995E-04 after    139 steps, step:  0.28200E-02
 mylbfgs> Energy and RMS force=    -273.6091288        0.8009400309E-04 after    140 steps, step:  0.44456E-02
 mylbfgs> Energy and RMS force=    -273.6091289        0.6513960768E-04 after    141 steps, step:  0.25237E-02
 mylbfgs> Energy and RMS force=    -273.6091292        0.7202789134E-04 after    142 steps, step:  0.38627E-02
 mylbfgs> Energy and RMS force=    -273.6091295        0.7557233901E-04 after    143 steps, step:  0.73363E-02
 mylbfgs> Energy and RMS force=    -273.6091293        0.3030293269E-03 after    144 steps, step:  0.80270E-02
 mylbfgs> Energy and RMS force=    -273.6091299        0.6005766107E-04 after    145 steps, step:  0.18802E-02
 mylbfgs> Energy and RMS force=    -273.6091299        0.4005555252E-04 after    146 steps, step:  0.96566E-03
 mylbfgs> Energy and RMS force=    -273.6091301        0.4781479192E-04 after    147 steps, step:  0.20504E-02
 mylbfgs> Energy and RMS force=    -273.6091302        0.5863193767E-04 after    148 steps, step:  0.21363E-02
 mylbfgs> Energy and RMS force=    -273.6091304        0.1744019524E-03 after    149 steps, step:  0.79359E-02
 mylbfgs> Energy and RMS force=    -273.6091308        0.7131085188E-04 after    150 steps, step:  0.32708E-02
 mylbfgs> Energy and RMS force=    -273.6091309        0.6050621124E-04 after    151 steps, step:  0.17605E-02
 mylbfgs> Energy and RMS force=    -273.6091312        0.8970493709E-04 after    152 steps, step:  0.48563E-02
 mylbfgs> Energy and RMS force=    -273.6091314        0.1183441748E-03 after    153 steps, step:  0.51400E-02
 mylbfgs> Energy and RMS force=    -273.6091316        0.8665401252E-04 after    154 steps, step:  0.18422E-02
 mylbfgs> Energy and RMS force=    -273.6091326        0.1224678969E-03 after    155 steps, step:  0.13597E-01
 mylbfgs> Energy and RMS force=    -273.6091332        0.1385097099E-03 after    156 steps, step:  0.90726E-02
 mylbfgs> Energy and RMS force=    -273.6091337        0.3004530386E-03 after    157 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091347        0.9462691200E-04 after    158 steps, step:  0.80580E-02
 mylbfgs> Energy and RMS force=    -273.6091350        0.8492929278E-04 after    159 steps, step:  0.70111E-02
 mylbfgs> Energy and RMS force=    -273.6091355        0.9931155193E-04 after    160 steps, step:  0.95889E-02
 mylbfgs> Energy and RMS force=    -273.6091360        0.1649522753E-03 after    161 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091368        0.1315601873E-03 after    162 steps, step:  0.11717E-01
 mylbfgs> Energy and RMS force=    -273.6091376        0.1559443903E-03 after    163 steps, step:  0.19167E-01
 mylbfgs> Energy and RMS force=    -273.6091386        0.2219424656E-03 after    164 steps, step:  0.15443E-01
 mylbfgs> Energy and RMS force=    -273.6091396        0.2130891132E-03 after    165 steps, step:  0.17383E-01
 mylbfgs> Energy and RMS force=    -273.6091410        0.1798773391E-03 after    166 steps, step:  0.33532E-02
 mylbfgs> Energy and RMS force=    -273.6091431        0.2154924263E-03 after    167 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091456        0.1913083268E-03 after    168 steps, step:  0.16496E-01
 mylbfgs> Energy and RMS force=    -273.6091471        0.2372229563E-03 after    169 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091493        0.2445088536E-03 after    170 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091515        0.2300909156E-03 after    171 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091523        0.2965944016E-03 after    172 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091537        0.2201487548E-03 after    173 steps, step:  0.17293E-01
 mylbfgs> Energy and RMS force=    -273.6091540        0.1139601219E-03 after    174 steps, step:  0.45815E-02
 mylbfgs> Energy and RMS force=    -273.6091549        0.1410668437E-03 after    175 steps, step:  0.16507E-01
 mylbfgs> Energy and RMS force=    -273.6091557        0.1802763073E-03 after    176 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091565        0.1944923847E-03 after    177 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091572        0.1966691019E-03 after    178 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091581        0.1200874002E-03 after    179 steps, step:  0.15868E-01
 mylbfgs> Energy and RMS force=    -273.6091586        0.1394738402E-03 after    180 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091594        0.7768543436E-04 after    181 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091597        0.1051159303E-03 after    182 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091600        0.1005421295E-03 after    183 steps, step:  0.15708E-01
 mylbfgs> Energy and RMS force=    -273.6091604        0.6795137085E-04 after    184 steps, step:  0.14815E-01
 mylbfgs> Energy and RMS force=    -273.6091608        0.1013648696E-03 after    185 steps, step:  0.19834E-01
 mylbfgs> Energy and RMS force=    -273.6091611        0.7314124235E-04 after    186 steps, step:  0.10197E-01
 mylbfgs> Energy and RMS force=    -273.6091613        0.1029610615E-03 after    187 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091615        0.5180722278E-04 after    188 steps, step:  0.25013E-02
 mylbfgs> Energy and RMS force=    -273.6091615        0.2270864391E-04 after    189 steps, step:  0.33107E-02
 mylbfgs> Energy and RMS force=    -273.6091616        0.3469063946E-04 after    190 steps, step:  0.36443E-02
 mylbfgs> Energy and RMS force=    -273.6091616        0.3401164338E-04 after    191 steps, step:  0.45612E-02
 mylbfgs> Energy and RMS force=    -273.6091616        0.4728069658E-04 after    192 steps, step:  0.93572E-02
 mylbfgs> Energy and RMS force=    -273.6091617        0.3113312184E-04 after    193 steps, step:  0.83538E-02
 mylbfgs> Energy and RMS force=    -273.6091617        0.1704591819E-04 after    194 steps, step:  0.42679E-02
 mylbfgs> Energy and RMS force=    -273.6091617        0.1321273099E-04 after    195 steps, step:  0.87699E-02
 mylbfgs> Energy and RMS force=    -273.6091617        0.2344034333E-04 after    196 steps, step:  0.97181E-03
 mylbfgs> Energy and RMS force=    -273.6091617        0.1821078700E-04 after    197 steps, step:  0.25283E-02
 mylbfgs> Energy and RMS force=    -273.6091618        0.1716560060E-04 after    198 steps, step:  0.67701E-02
 mylbfgs> Energy and RMS force=    -273.6091618        0.3905262736E-04 after    199 steps, step:  0.13299E-02
 mylbfgs> Energy and RMS force=    -273.6091618        0.2252218883E-04 after    200 steps, step:  0.12304E-02
 mylbfgs> Energy and RMS force=    -273.6091618        0.1632141324E-04 after    201 steps, step:  0.91157E-03
 mylbfgs> Energy and RMS force=    -273.6091618        0.2267152177E-04 after    202 steps, step:  0.64201E-03
 mylbfgs> Energy and RMS force=    -273.6091618        0.3194969655E-04 after    203 steps, step:  0.15517E-02
 mylbfgs> Energy and RMS force=    -273.6091619        0.5997121395E-04 after    204 steps, step:  0.38025E-02
 mylbfgs> Energy and RMS force=    -273.6091620        0.6103309011E-04 after    205 steps, step:  0.82065E-02
 mylbfgs> Energy and RMS force=    -273.6091622        0.6090902102E-04 after    206 steps, step:  0.81878E-02
 mylbfgs> Energy and RMS force=    -273.6091626        0.1030094442E-03 after    207 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091629        0.9753471083E-04 after    208 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091631        0.9635104076E-04 after    209 steps, step:  0.16996E-01
 mylbfgs> Energy and RMS force=    -273.6091634        0.7655964365E-04 after    210 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091636        0.7515373388E-04 after    211 steps, step:  0.12326E-01
 mylbfgs> Energy and RMS force=    -273.6091639        0.7492924246E-04 after    212 steps, step:  0.67539E-02
 mylbfgs> Energy and RMS force=    -273.6091640        0.8584066762E-04 after    213 steps, step:  0.14532E-01
 mylbfgs> Energy and RMS force=    -273.6091642        0.4688763629E-04 after    214 steps, step:  0.10502E-01
 mylbfgs> Energy and RMS force=    -273.6091643        0.4281205178E-04 after    215 steps, step:  0.78738E-02
 mylbfgs> Energy and RMS force=    -273.6091643        0.3145972355E-04 after    216 steps, step:  0.43018E-02
 mylbfgs> Energy and RMS force=    -273.6091643        0.2377685280E-04 after    217 steps, step:  0.32066E-02
 mylbfgs> Energy and RMS force=    -273.6091644        0.3857935833E-04 after    218 steps, step:  0.12699E-01
 mylbfgs> Energy and RMS force=    -273.6091644        0.1461769008E-04 after    219 steps, step:  0.32597E-02
 mylbfgs> Energy and RMS force=    -273.6091644        0.8415732352E-05 after    220 steps, step:  0.19062E-02
 mylbfgs> Diagonal inverse Hessian elements are now         0.8888255840
 mylbfgs> Final energy is   -273.60916439702498    
 Plus  side of path:                     221 steps. Energy=    -273.6091644       time=       0.90
 golden> golden a, b, c, d=     0.000000000       -0.1000000000       -0.3819660113E-01   -0.6180339887E-01 initially
 golden> energy at ts, C and D and diff=    -273.605034441041        -273.605092684377        -273.605191668494       -0.157227452973530E-03
 golden> energy at ts, C and D and diff=    -273.605034441041        -273.605191668373        -273.605278869603       -0.244428561984478E-03
 golden> energy at ts, C and D and diff=    -273.605034441041        -273.605278869562        -273.605343080191       -0.308639149977807E-03
 golden> energy at ts, C and D and diff=    -273.605034441041        -273.605343080416        -273.605386778721       -0.352337679998982E-03
 golden> energy at ts, C and D and diff=    -273.605034441041        -273.605386778913        -273.605415333816       -0.380892774956010E-03
 golden> energy at ts, C and D and diff=    -273.605034441041        -273.605415333998        -273.605433576138       -0.399135096984082E-03
 golden> energy at ts, C and D and diff=    -273.605034441041        -273.605433576241        -273.605445078146       -0.410637104948819E-03
 golden> energy at ts, C and D and diff=    -273.605034441041        -273.605445078300        -273.605452273874       -0.417832832965814E-03
 golden> energy at ts, C and D and diff=    -273.605034441041        -273.605452273917        -273.605456754375       -0.422313333956481E-03
 golden> energy at ts, C and D and diff=    -273.605034441041        -273.605456754425        -273.605459536358       -0.425095316984425E-03
 path> golden section - pushoff, energy, delta, step:     -273.605459536358       -0.425095316984425E-03   -0.995934690628392E-01
 mylbfgs> Resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6054604        0.1361362037E-02 after      0 steps
 mylbfgs> Energy and RMS force=    -273.6054605        0.1361304697E-02 after      1 steps, step:  0.83399E-05
 mylbfgs> Energy and RMS force=    -273.6056609        0.1691105897E-02 after      2 steps, step:  0.20000E-01
 mylbfgs> Resetting LBFGS routine - step scaling factor was     0.5084746435E-01
 mylbfgs> Energy and RMS force=    -273.6056610        0.1691079926E-02 after      3 steps, step:  0.12869E-04
 mylbfgs> Energy and RMS force=    -273.6058877        0.2344915366E-02 after      4 steps, step:  0.20000E-01
 mylbfgs> Resetting LBFGS routine - step scaling factor was     0.1210564420E-01
 mylbfgs> Energy and RMS force=    -273.6058881        0.2341935434E-02 after      5 steps, step:  0.24744E-04
 mylbfgs> Energy and RMS force=    -273.6061479        0.2774135227E-02 after      6 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6063817        0.4407710033E-02 after      7 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6066218        0.5958301337E-02 after      8 steps, step:  0.20000E-01
 mylbfgs> Resetting LBFGS routine - step scaling factor was     0.5633636033E-01
 mylbfgs> Energy and RMS force=    -273.6066282        0.5905650103E-02 after      9 steps, step:  0.15976E-03
 mylbfgs> Energy and RMS force=    -273.6071232        0.3115793932E-02 after     10 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6074172        0.4862421916E-02 after     11 steps, step:  0.19571E-01
 mylbfgs> Energy and RMS force=    -273.6077305        0.6489791869E-02 after     12 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6080631        0.7848239371E-02 after     13 steps, step:  0.20000E-01
 mylbfgs> Resetting LBFGS routine - step scaling factor was     0.4826652224E-01
 mylbfgs> Energy and RMS force=    -273.6080776        0.7750391530E-02 after     14 steps, step:  0.27718E-03
 mylbfgs> Energy and RMS force=    -273.6087851        0.3819163491E-02 after     15 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091916        0.4725662454E-02 after     16 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6095642        0.6189290950E-02 after     17 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6099454        0.7292201113E-02 after     18 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6103353        0.8075753439E-02 after     19 steps, step:  0.20000E-01
 mylbfgs> Resetting LBFGS routine - step scaling factor was     0.8576726262E-01
 mylbfgs> Energy and RMS force=    -273.6103511        0.7975291618E-02 after     20 steps, step:  0.29348E-03
 mylbfgs> Energy and RMS force=    -273.6110782        0.3745820858E-02 after     21 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6114652        0.4270157911E-02 after     22 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6118026        0.5444182550E-02 after     23 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6121448        0.6079015988E-02 after     24 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6124924        0.6272891140E-02 after     25 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6128371        0.6196846772E-02 after     26 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6131480        0.6048764096E-02 after     27 steps, step:  0.20000E-01
 mylbfgs> Resetting LBFGS routine - step scaling factor was     0.5922913670E-01
 mylbfgs> Energy and RMS force=    -273.6131546        0.5983582078E-02 after     28 steps, step:  0.16464E-03
 mylbfgs> Energy and RMS force=    -273.6135425        0.2218890568E-02 after     29 steps, step:  0.18020E-01
 mylbfgs> Energy and RMS force=    -273.6136339        0.2535544530E-02 after     30 steps, step:  0.79323E-02
 mylbfgs> Energy and RMS force=    -273.6138587        0.3001954620E-02 after     31 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6140694        0.3127641314E-02 after     32 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6142397        0.3391865360E-02 after     33 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6144143        0.3053268135E-02 after     34 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6145631        0.2707386966E-02 after     35 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6146862        0.2234133668E-02 after     36 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6147859        0.1633879873E-02 after     37 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6148548        0.1239379683E-02 after     38 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6149049        0.6212055840E-03 after     39 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6149361        0.4720259421E-03 after     40 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6149623        0.8273728985E-03 after     41 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6149845        0.1101556805E-02 after     42 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6149954        0.1033912949E-02 after     43 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6150143        0.8763559187E-03 after     44 steps, step:  0.98276E-02
 mylbfgs> Energy and RMS force=    -273.6150378        0.4221618715E-03 after     45 steps, step:  0.11185E-01
 mylbfgs> Energy and RMS force=    -273.6150569        0.7415451905E-03 after     46 steps, step:  0.17025E-01
 mylbfgs> Energy and RMS force=    -273.6150738        0.1017983291E-02 after     47 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6150898        0.1054817292E-02 after     48 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6151056        0.7954652941E-03 after     49 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6151182        0.4735575208E-03 after     50 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6151240        0.4299231876E-03 after     51 steps, step:  0.50241E-02
 mylbfgs> Energy and RMS force=    -273.6151283        0.4672615461E-03 after     52 steps, step:  0.37485E-02
 mylbfgs> Energy and RMS force=    -273.6151342        0.4363670957E-03 after     53 steps, step:  0.75555E-02
 mylbfgs> Energy and RMS force=    -273.6151375        0.5118819584E-03 after     54 steps, step:  0.11977E-01
 mylbfgs> Energy and RMS force=    -273.6151400        0.1587016387E-03 after     55 steps, step:  0.24115E-02
 mylbfgs> Energy and RMS force=    -273.6151407        0.9632363937E-04 after     56 steps, step:  0.26596E-02
 mylbfgs> Energy and RMS force=    -273.6151410        0.9593818106E-04 after     57 steps, step:  0.13479E-02
 mylbfgs> Energy and RMS force=    -273.6151418        0.7786453012E-04 after     58 steps, step:  0.29270E-02
 mylbfgs> Energy and RMS force=    -273.6151426        0.1298826350E-03 after     59 steps, step:  0.44600E-02
 mylbfgs> Energy and RMS force=    -273.6151433        0.1353691288E-03 after     60 steps, step:  0.56174E-02
 mylbfgs> Energy and RMS force=    -273.6151439        0.9277403081E-04 after     61 steps, step:  0.20984E-02
 mylbfgs> Energy and RMS force=    -273.6151443        0.7892340136E-04 after     62 steps, step:  0.29636E-02
 mylbfgs> Energy and RMS force=    -273.6151448        0.8744055607E-04 after     63 steps, step:  0.31974E-02
 mylbfgs> Energy and RMS force=    -273.6151453        0.7107289790E-04 after     64 steps, step:  0.56661E-02
 mylbfgs> Energy and RMS force=    -273.6151456        0.6029973026E-04 after     65 steps, step:  0.22031E-02
 mylbfgs> Energy and RMS force=    -273.6151461        0.5906511082E-04 after     66 steps, step:  0.39868E-02
 mylbfgs> Energy and RMS force=    -273.6151464        0.9442062263E-04 after     67 steps, step:  0.48631E-02
 mylbfgs> Energy and RMS force=    -273.6151468        0.4747469428E-04 after     68 steps, step:  0.33784E-02
 mylbfgs> Energy and RMS force=    -273.6151471        0.4817378780E-04 after     69 steps, step:  0.25494E-02
 mylbfgs> Energy and RMS force=    -273.6151474        0.5603551770E-04 after     70 steps, step:  0.44170E-02
 mylbfgs> Energy and RMS force=    -273.6151478        0.4547920653E-04 after     71 steps, step:  0.55210E-02
 mylbfgs> Energy and RMS force=    -273.6151483        0.8423317529E-04 after     72 steps, step:  0.94291E-02
 mylbfgs> Energy and RMS force=    -273.6151486        0.4268428308E-04 after     73 steps, step:  0.51446E-02
 mylbfgs> Energy and RMS force=    -273.6151488        0.3960560187E-04 after     74 steps, step:  0.19225E-02
 mylbfgs> Energy and RMS force=    -273.6151491        0.3570656184E-04 after     75 steps, step:  0.40294E-02
 mylbfgs> Energy and RMS force=    -273.6151493        0.4167502495E-04 after     76 steps, step:  0.47460E-02
 mylbfgs> Energy and RMS force=    -273.6151494        0.2951348091E-04 after     77 steps, step:  0.33582E-02
 mylbfgs> Energy and RMS force=    -273.6151496        0.2370168000E-04 after     78 steps, step:  0.41154E-02
 mylbfgs> Energy and RMS force=    -273.6151496        0.2879761372E-04 after     79 steps, step:  0.13633E-02
 mylbfgs> Energy and RMS force=    -273.6151497        0.2222786235E-04 after     80 steps, step:  0.84723E-03
 mylbfgs> Energy and RMS force=    -273.6151497        0.2965748854E-04 after     81 steps, step:  0.22284E-02
 mylbfgs> Energy and RMS force=    -273.6151498        0.4231686050E-04 after     82 steps, step:  0.24215E-02
 mylbfgs> Energy and RMS force=    -273.6151499        0.6180317836E-04 after     83 steps, step:  0.56704E-02
 mylbfgs> Energy and RMS force=    -273.6151500        0.4475588000E-04 after     84 steps, step:  0.60719E-03
 mylbfgs> Energy and RMS force=    -273.6151500        0.2908364307E-04 after     85 steps, step:  0.54899E-03
 mylbfgs> Energy and RMS force=    -273.6151501        0.3753647347E-04 after     86 steps, step:  0.15706E-02
 mylbfgs> Energy and RMS force=    -273.6151502        0.5599058716E-04 after     87 steps, step:  0.46973E-02
 mylbfgs> Energy and RMS force=    -273.6151504        0.4945651710E-04 after     88 steps, step:  0.67061E-02
 mylbfgs> Energy and RMS force=    -273.6151493        0.4107698793E-03 after     89 steps, step:  0.65928E-02
 mylbfgs> Energy and RMS force=    -273.6151505        0.2670852001E-04 after     90 steps, step:  0.25676E-02
 mylbfgs> Energy and RMS force=    -273.6151505        0.1415326106E-04 after     91 steps, step:  0.18248E-03
 mylbfgs> Energy and RMS force=    -273.6151505        0.1064856753E-04 after     92 steps, step:  0.22149E-03
 mylbfgs> Energy and RMS force=    -273.6151505        0.1306450327E-04 after     93 steps, step:  0.21931E-03
 mylbfgs> Energy and RMS force=    -273.6151505        0.2227159370E-04 after     94 steps, step:  0.12504E-02
 mylbfgs> Energy and RMS force=    -273.6151505        0.7613004569E-04 after     95 steps, step:  0.20112E-02
 mylbfgs> Energy and RMS force=    -273.6151506        0.3292266843E-04 after     96 steps, step:  0.79273E-03
 mylbfgs> Energy and RMS force=    -273.6151506        0.2015300258E-04 after     97 steps, step:  0.12542E-02
 mylbfgs> Energy and RMS force=    -273.6151506        0.2308409252E-04 after     98 steps, step:  0.15118E-02
 mylbfgs> Energy and RMS force=    -273.6151507        0.2582008335E-04 after     99 steps, step:  0.21158E-02
 mylbfgs> Energy and RMS force=    -273.6151507        0.5211630806E-04 after    100 steps, step:  0.56155E-02
 mylbfgs> Energy and RMS force=    -273.6151507        0.1072041074E-03 after    101 steps, step:  0.73235E-02
 mylbfgs> Energy and RMS force=    -273.6151508        0.2042271124E-04 after    102 steps, step:  0.34055E-02
 mylbfgs> Energy and RMS force=    -273.6151508        0.1481654580E-04 after    103 steps, step:  0.36887E-03
 mylbfgs> Energy and RMS force=    -273.6151508        0.1831120908E-04 after    104 steps, step:  0.51700E-03
 mylbfgs> Energy and RMS force=    -273.6151509        0.5594420797E-04 after    105 steps, step:  0.96507E-03
 mylbfgs> Energy and RMS force=    -273.6151509        0.3271227820E-04 after    106 steps, step:  0.12126E-02
 mylbfgs> Energy and RMS force=    -273.6151510        0.2562422245E-04 after    107 steps, step:  0.33668E-02
 mylbfgs> Energy and RMS force=    -273.6151510        0.2585317283E-04 after    108 steps, step:  0.36439E-02
 mylbfgs> Energy and RMS force=    -273.6151510        0.6569558748E-04 after    109 steps, step:  0.21873E-02
 mylbfgs> Energy and RMS force=    -273.6151510        0.8564433158E-05 after    110 steps, step:  0.59098E-03
 mylbfgs> Diagonal inverse Hessian elements are now         0.6619327363
 mylbfgs> Final energy is   -273.61515101659501    
 Minus side of path:                     111 steps. Energy=    -273.6151510       time=       0.41
 path> number of entries in EofS file=   333
 Frames will be dumped to path.xyz with probability     0.4545/    0.9091 steps on the plus/minus sides
 Transition state will be frame number     50

         E+        Ets - E+           Ets       Ets - E-           E-          S       D      gamma   ~N
     -273.6091644 0.41300E-02     -273.6050344 0.10117E-01     -273.6151510   4.117   1.777   4.545   3.300
 minpermdist> initial energy for structure A=                  -273.615151016478990 RMS=        0.000008567063409
 minpermdist> initial energy for structure B=                  -273.615151023319015 RMS=        0.000008854809106
isnewmin> minimum distance=    0.3285028475E-01
isnewmin> MINPOS=     1
 potential> allocating hessian with dimension         45
 orca_subp> ORCA numerical Hessian calculation
 orca_subp> ORCA numerical Hessian calculation
 orca_subp> ORCA numerical Hessian calculation
        *NEW* (Placed in 3)                                     Known (#1)
 minpermdist> initial energy for structure A=                  -273.609164396789993 RMS=        0.000008415915629
 minpermdist> initial energy for structure B=                  -273.615151023522003 RMS=        0.000008852059613
 addnewmin> distance from MINPERMDIST/NEWMINDIST=     1.764554164     for      1 and      3
 minpermdist> initial energy for structure A=                  -273.609162036592011 RMS=        0.000008918823794
 minpermdist> initial energy for structure B=                  -273.607272188983984 RMS=        0.000010914886177
 addnewmin> distance from MINPERMDIST/NEWMINDIST=     1.760726853     for      2 and      3
 Unconnected minimum 3 found its way to S set.
 >>>>>>>>>>>>>>>>>>>>> CONNECT CYCLE 2 >>>>>>>>>>>>>>>>>>>>> 3 minima and 1 ts are known >>>>>>>>>>>>>>>>>>>>
 decide> Shortest path in Dijkstra has      2 steps with      1 missing connections, weight=     3.1002    
 decide> The unconnected minima in the chain and their distances are:
     2        1.76     3 
 
 minpermdist> initial energy for structure A=                  -273.609160568222990 RMS=        0.000011133300313
 minpermdist> WARNING *** RMS for structure A is outside tolerance
 minpermdist> initial energy for structure B=                  -273.607272188836987 RMS=        0.000010914851196

 tryconnect> Interpolation for minima 2_F and 3_S using 1 initial images  (interp attempt set to #1)  ...
 intlbfgs> extra distance before turning on constraint potential is initially     0.200000
 intlbfgs> End minima distance=     1.760726853     density      50.00000000     images set to                    1
 intlbfgs> Maximum number of steps for constraint potential phase is 300000
 intlbfgs> Updates:      4 maximum step size=    0.2000000000    
 intlbfgs> Total number of atoms moving less than threshold=     0
 intlbfgs> Total distance constraints=     6 shortest=        1.01331 longest=        1.01456
 checkperc> steps to atom 1 converged in        0 cycles; maximum=       0 disconnected=      14
 checkperc> increasing the local constraint tolerance parameter to         0.00110
 intlbfgs> Total distance constraints=     6 shortest=        1.01331 longest=        1.01456
 checkperc> steps to atom 1 converged in        0 cycles; maximum=       0 disconnected=      14
 checkperc> increasing the local constraint tolerance parameter to         0.00121
 intlbfgs> Total distance constraints=     7 shortest=        1.01331 longest=        1.08346
 checkperc> steps to atom 1 converged in        0 cycles; maximum=       0 disconnected=      14
 checkperc> increasing the local constraint tolerance parameter to         0.00133
 intlbfgs> Total distance constraints=     8 shortest=        1.01331 longest=        4.27766
 checkperc> steps to atom 1 converged in        0 cycles; maximum=       0 disconnected=      14
 checkperc> increasing the local constraint tolerance parameter to         0.00146
 intlbfgs> Total distance constraints=     8 shortest=        1.01331 longest=        4.27766
 checkperc> steps to atom 1 converged in        0 cycles; maximum=       0 disconnected=      14
 checkperc> increasing the local constraint tolerance parameter to         0.00161
 intlbfgs> Total distance constraints=     9 shortest=        1.01331 longest=        4.27766
 checkperc> steps to atom 1 converged in        1 cycles; maximum=       2 disconnected=      12
 checkperc> increasing the local constraint tolerance parameter to         0.00177
 intlbfgs> Total distance constraints=    10 shortest=        1.01331 longest=        4.84683
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       4 disconnected=       8
 checkperc> increasing the local constraint tolerance parameter to         0.00195
 intlbfgs> Total distance constraints=    11 shortest=        1.01331 longest=        5.20772
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       3 disconnected=       8
 checkperc> increasing the local constraint tolerance parameter to         0.00214
 intlbfgs> Total distance constraints=    11 shortest=        1.01331 longest=        5.20772
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       3 disconnected=       8
 checkperc> increasing the local constraint tolerance parameter to         0.00236
 intlbfgs> Total distance constraints=    11 shortest=        1.01331 longest=        5.20772
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       3 disconnected=       8
 checkperc> increasing the local constraint tolerance parameter to         0.00259
 intlbfgs> Total distance constraints=    12 shortest=        1.01331 longest=        5.20772
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       3 disconnected=       8
 checkperc> increasing the local constraint tolerance parameter to         0.00285
 intlbfgs> Total distance constraints=    12 shortest=        1.01331 longest=        5.20772
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       3 disconnected=       8
 checkperc> increasing the local constraint tolerance parameter to         0.00314
 intlbfgs> Total distance constraints=    13 shortest=        1.01331 longest=        5.20772
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       3 disconnected=       7
 checkperc> increasing the local constraint tolerance parameter to         0.00345
 intlbfgs> Total distance constraints=    15 shortest=        1.01331 longest=        5.20772
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       3 disconnected=       6
 checkperc> increasing the local constraint tolerance parameter to         0.00380
 intlbfgs> Total distance constraints=    16 shortest=        1.01331 longest=        5.20772
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       3 disconnected=       6
 checkperc> increasing the local constraint tolerance parameter to         0.00418
 intlbfgs> Total distance constraints=    16 shortest=        1.01331 longest=        5.20772
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       3 disconnected=       6
 checkperc> increasing the local constraint tolerance parameter to         0.00459
 intlbfgs> Total distance constraints=    16 shortest=        1.01331 longest=        5.20772
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       3 disconnected=       6
 checkperc> increasing the local constraint tolerance parameter to         0.00505
 intlbfgs> Total distance constraints=    16 shortest=        1.01331 longest=        5.20772
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       3 disconnected=       6
 checkperc> increasing the local constraint tolerance parameter to         0.00556
 intlbfgs> Total distance constraints=    16 shortest=        1.01331 longest=        5.20772
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       3 disconnected=       6
 checkperc> increasing the local constraint tolerance parameter to         0.00612
 intlbfgs> Total distance constraints=    17 shortest=        1.01331 longest=        5.20772
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       3 disconnected=       6
 checkperc> increasing the local constraint tolerance parameter to         0.00673
 intlbfgs> Total distance constraints=    19 shortest=        1.01331 longest=        5.20772
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       3 disconnected=       6
 checkperc> increasing the local constraint tolerance parameter to         0.00740
 intlbfgs> Total distance constraints=    19 shortest=        1.01331 longest=        5.20772
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       3 disconnected=       6
 checkperc> increasing the local constraint tolerance parameter to         0.00814
 intlbfgs> Total distance constraints=    22 shortest=        1.01331 longest=        5.20772
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       2 disconnected=       6
 checkperc> increasing the local constraint tolerance parameter to         0.00895
 intlbfgs> Total distance constraints=    22 shortest=        1.01331 longest=        5.20772
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       2 disconnected=       6
 checkperc> increasing the local constraint tolerance parameter to         0.00985
 intlbfgs> Total distance constraints=    23 shortest=        1.01331 longest=        5.20772
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       2 disconnected=       6
 checkperc> increasing the local constraint tolerance parameter to         0.01083
 intlbfgs> Total distance constraints=    24 shortest=        1.01331 longest=        5.20772
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       2 disconnected=       6
 checkperc> increasing the local constraint tolerance parameter to         0.01192
 intlbfgs> Total distance constraints=    26 shortest=        1.01331 longest=        5.39787
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       2 disconnected=       6
 checkperc> increasing the local constraint tolerance parameter to         0.01311
 intlbfgs> Total distance constraints=    27 shortest=        1.01331 longest=        5.39787
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       2 disconnected=       6
 checkperc> increasing the local constraint tolerance parameter to         0.01442
 intlbfgs> Total distance constraints=    28 shortest=        1.01331 longest=        5.39787
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       3 disconnected=       1
 checkperc> increasing the local constraint tolerance parameter to         0.01586
 intlbfgs> Total distance constraints=    30 shortest=        1.01331 longest=        5.39787
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       3 disconnected=       1
 checkperc> increasing the local constraint tolerance parameter to         0.01745
 intlbfgs> Total distance constraints=    30 shortest=        1.01331 longest=        5.39787
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       3 disconnected=       1
 checkperc> increasing the local constraint tolerance parameter to         0.01919
 intlbfgs> Total distance constraints=    30 shortest=        1.01331 longest=        5.39787
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       3 disconnected=       1
 checkperc> increasing the local constraint tolerance parameter to         0.02111
 intlbfgs> Total distance constraints=    32 shortest=        1.01331 longest=        5.39787
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       2 disconnected=       1
 checkperc> increasing the local constraint tolerance parameter to         0.02323
 intlbfgs> Total distance constraints=    33 shortest=        1.01331 longest=        5.39787
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       2 disconnected=       1
 checkperc> increasing the local constraint tolerance parameter to         0.02555
 intlbfgs> Total distance constraints=    34 shortest=        1.01331 longest=        5.39787
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       2 disconnected=       1
 checkperc> increasing the local constraint tolerance parameter to         0.02810
 intlbfgs> Total distance constraints=    35 shortest=        1.01331 longest=        5.39787
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       2 disconnected=       1
 checkperc> increasing the local constraint tolerance parameter to         0.03091
 intlbfgs> Total distance constraints=    37 shortest=        1.01331 longest=        5.39787
 checkperc> steps to atom 1 converged in        1 cycles; maximum=       2 disconnected=       1
 checkperc> increasing the local constraint tolerance parameter to         0.03400
 intlbfgs> Total distance constraints=    37 shortest=        1.01331 longest=        5.39787
 checkperc> steps to atom 1 converged in        1 cycles; maximum=       2 disconnected=       1
 checkperc> increasing the local constraint tolerance parameter to         0.03740
 intlbfgs> Total distance constraints=    37 shortest=        1.01331 longest=        5.39787
 checkperc> steps to atom 1 converged in        1 cycles; maximum=       2 disconnected=       1
 checkperc> increasing the local constraint tolerance parameter to         0.04114
 intlbfgs> Total distance constraints=    40 shortest=        1.01331 longest=        5.48988
 checkperc> steps to atom 1 converged in        1 cycles; maximum=       2 disconnected=       1
 checkperc> increasing the local constraint tolerance parameter to         0.04526
 intlbfgs> Total distance constraints=    40 shortest=        1.01331 longest=        5.48988
 checkperc> steps to atom 1 converged in        1 cycles; maximum=       2 disconnected=       1
 checkperc> increasing the local constraint tolerance parameter to         0.04979
 intlbfgs> Total distance constraints=    42 shortest=        1.01331 longest=        5.48988
 checkperc> steps to atom 1 converged in        1 cycles; maximum=       2 disconnected=       1
 checkperc> increasing the local constraint tolerance parameter to         0.05476
 intlbfgs> Total distance constraints=    42 shortest=        1.01331 longest=        5.48988
 checkperc> steps to atom 1 converged in        1 cycles; maximum=       2 disconnected=       1
 checkperc> increasing the local constraint tolerance parameter to         0.06024
 intlbfgs> Total distance constraints=    43 shortest=        1.01331 longest=        5.48988
 checkperc> steps to atom 1 converged in        1 cycles; maximum=       2 disconnected=       1
 checkperc> increasing the local constraint tolerance parameter to         0.06626
 intlbfgs> Total distance constraints=    45 shortest=        1.01331 longest=        5.48988
 checkperc> steps to atom 1 converged in        1 cycles; maximum=       2 disconnected=       1
 checkperc> increasing the local constraint tolerance parameter to         0.07289
 intlbfgs> Total distance constraints=    45 shortest=        1.01331 longest=        5.48988
 checkperc> steps to atom 1 converged in        1 cycles; maximum=       2 disconnected=       1
 checkperc> increasing the local constraint tolerance parameter to         0.08018
 intlbfgs> Total distance constraints=    49 shortest=        1.01331 longest=        5.48988
 checkperc> steps to atom 1 converged in        1 cycles; maximum=       2 disconnected=       0
          11
 intlbfgs> maximum constraints     11 for atom      1
 intlbfgs> largest number of common constraint atoms for any group is:     -1
 intlbfgs> Smallest overall motion for constraint     28 atoms      4    12 distance=        0.20699
 intlbfgs> Largest overall motion for constraint      40 atoms      7    10 distance=        1.70514
 intlbfgs> Turning on constraint     28 for atoms      4    12
 intlbfgs> Number of active atoms is now      2
 intlbfgs> constrained potential finished, time=       0.0 number of repulsions=     0
 checkrep> number of active repulsions and total=       0       0
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7366184692E-01    0.2331468352E-12
 intlbfgs> largest atomic distance between images is     0.5768340636E-01 for atom      4 and images      1     2 total images=     1
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7366184692E-01    0.2331468352E-12
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:      1   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.7960498581E-18         2     3
 intlbfgs> largest atomic distance between images is     0.5768340636E-01 for atom      4 and images      2     3 total images=     1
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.7366184692E-01    0.1182387521E-11
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:      2   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.1998401444E-14         2     3
 intlbfgs> Choosing new active atom       13 new constraints=       2 maximum constraints available and possible=       2       2 shortest constraint=        1.01427
 intlbfgs> New active atom     13 closest average distances in endpoints:
     4    12
 intlbfgs> sorted average distances:
   1.014       1.625    
 intlbfgs> New active atom is number     13 total=     3 steps=     3
 intlbfgs> New active atom     13 is constrained to      2 other active atoms:
     4    12
 intlbfgs> sorted distances:
   1.014       1.625    
 intlbfgs> Turning on constraint     29 for atoms      4    13
 intlbfgs> Turning on constraint     47 for atoms     12    13
 checkrep> number of active repulsions and total=       0       0
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.1552375300        0.1887379142E-12
 intlbfgs> energies for constrained, preserved, closest, and linear schemes=    0.10000+101    0.10000+101    0.10000+101     0.0000    
 intlbfgs> lowest energy from linear interpolation
 checkrep> number of active repulsions and total=       0       0
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.1552375300        0.1887379142E-12
 intlbfgs> largest atomic distance between images is     0.1366478065     for atom     13 and images      1     2 total images=     1
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.1552375300        0.9992007222E-13
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:      3   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.2002274049E-14         3     3
 intlbfgs> Choosing new active atom       11 new constraints=       3 maximum constraints available and possible=       3       3 shortest constraint=        1.01447
 intlbfgs> New active atom     11 closest average distances in endpoints:
     4    12    13
 intlbfgs> sorted average distances:
   1.014       1.627       1.630    
 intlbfgs> New active atom is number     11 total=     4 steps=     4
 intlbfgs> New active atom     11 is constrained to      3 other active atoms:
     4    12    13
 intlbfgs> sorted distances:
   1.014       1.627       1.630    
 intlbfgs> Turning on constraint     27 for atoms      4    11
 intlbfgs> Turning on constraint     45 for atoms     11    12
 intlbfgs> Turning on constraint     46 for atoms     11    13
 intlbfgs> initial guess from closest three constrained active atoms,      4    12    13
 checkrep> number of active repulsions and total=       0       0
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.2415044306         4.878228263    
 intlbfgs> energies for constrained, preserved, closest, and linear schemes=     0.0000        0.10000+101    0.10000+101    0.10000+101
 intlbfgs> interpolation using closest constraints
 checkrep> number of active repulsions and total=       0       0
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.2415044306         4.878228263    
 intlbfgs> largest atomic distance between images is     0.1856332173     for atom     11 and images      2     3 total images=     1
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.2408313658        0.4804302273    
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:      4   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.1948488513E-01         4     3
 intlbfgs> Mean deviation     0.4804302273     Decreasing QCI force constant to      2.970297030    
 intlbfgs> Choosing new active atom        1 new constraints=       3 maximum constraints available and possible=       3       3 shortest constraint=        2.46124
 intlbfgs> New active atom      1 closest average distances in endpoints:
    12     4    13    11
 intlbfgs> sorted average distances:
   2.461       2.899       3.301       3.791    
 intlbfgs> New active atom is number      1 total=     5 steps=     5
 intlbfgs> New active atom      1 is constrained to      3 other active atoms:
    12     4    11
 intlbfgs> sorted distances:
   2.461       2.899       3.791    
 intlbfgs> Turning on constraint     10 for atoms      1    12
 intlbfgs> Turning on constraint      3 for atoms      1     4
 intlbfgs> Turning on constraint      9 for atoms      1    11
 intlbfgs> initial guess from closest three constrained active atoms,     12     4    11
 checkrep> number of active repulsions and total=       1       1
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.3284174255         22.79107583    
 intlbfgs> energies for constrained, preserved, closest, and linear schemes=     0.0000        0.10000+101    0.10000+101    0.10000+101
 intlbfgs> interpolation using closest constraints
 checkrep> number of active repulsions and total=       1       1
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.3284174255         22.79107583    
 intlbfgs> largest atomic distance between images is     0.1841288619     for atom     11 and images      2     3 total images=     1
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.2926381841        0.2842063980    
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:      5   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.1651580024             5     3
 intlbfgs> Choosing new active atom        3 new constraints=       2 maximum constraints available and possible=       3       2 shortest constraint=        1.08925
 intlbfgs> New active atom      3 closest average distances in endpoints:
     1    12     4    13    11
 intlbfgs> sorted average distances:
   1.089       2.693       2.930       3.556       3.684    
 intlbfgs> New active atom is number      3 total=     6 steps=     6
 intlbfgs> New active atom      3 is constrained to      2 other active atoms:
     1    13
 intlbfgs> sorted distances:
   1.089       3.556    
 intlbfgs> Turning on constraint      2 for atoms      1     3
 intlbfgs> Turning on constraint     24 for atoms      3    13
 intlbfgs> choosing positions      1     2     3 in closest list
 checkrep> number of active repulsions and total=       4       4
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.3084761255        0.2440279805    
 intlbfgs> energies for constrained, preserved, closest, and linear schemes=    0.10000+101    0.10000+101     0.0000        0.10000+101
 intlbfgs> lowest energy from interpolation using closest atoms
 checkrep> number of active repulsions and total=       4       4
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.3084761255        0.2440279805    
 intlbfgs> largest atomic distance between images is     0.1841138766     for atom     11 and images      1     2 total images=     1
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.3083908456        0.3330669074E-13
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:      6   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.7291982187E-02         6     3
 intlbfgs> Choosing new active atom        8 new constraints=       3 maximum constraints available and possible=       4       3 shortest constraint=        1.08346
 intlbfgs> New active atom      8 closest average distances in endpoints:
     3     1    12     4    13    11
 intlbfgs> sorted average distances:
   1.083       1.765       3.767       3.955       4.524       4.703    
 intlbfgs> New active atom is number      8 total=     7 steps=     7
 intlbfgs> New active atom      8 is constrained to      3 other active atoms:
     3     1    13
 intlbfgs> sorted distances:
   1.083       1.765       4.524    
 intlbfgs> Turning on constraint     22 for atoms      3     8
 intlbfgs> Turning on constraint      7 for atoms      1     8
 intlbfgs> Turning on constraint     42 for atoms      8    13
 intlbfgs> initial guess from closest three constrained active atoms,      3     1    13
 checkrep> number of active repulsions and total=       7       7
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.3282856388         3.663029168    
 intlbfgs> energies for constrained, preserved, closest, and linear schemes=     0.0000        0.10000+101    0.10000+101    0.10000+101
 intlbfgs> interpolation using closest constraints
 checkrep> number of active repulsions and total=       7       7
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.3282856388         3.663029168    
 intlbfgs> largest atomic distance between images is     0.1841138766     for atom     11 and images      2     3 total images=     1
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.3178367934        0.1054711873E-12
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:      7   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.8304118753E-01         7     3
 intlbfgs> Choosing new active atom        7 new constraints=       3 maximum constraints available and possible=       5       3 shortest constraint=        1.09166
 intlbfgs> New active atom      7 closest average distances in endpoints:
     3     8     1    12     4    11    13
 intlbfgs> sorted average distances:
   1.092       1.768       1.785       2.666       3.077       3.609       3.894    
 intlbfgs> New active atom is number      7 total=     8 steps=     8
 intlbfgs> New active atom      7 is constrained to      3 other active atoms:
     3     8     1
 intlbfgs> sorted distances:
   1.092       1.768       1.785    
 intlbfgs> Turning on constraint     21 for atoms      3     7
 intlbfgs> Turning on constraint     38 for atoms      7     8
 intlbfgs> Turning on constraint      6 for atoms      1     7
 intlbfgs> initial guess from closest three constrained active atoms,      3     8     1
 checkrep> number of active repulsions and total=      11      11
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.3956115552        0.7681234562    
 intlbfgs> energies for constrained, preserved, closest, and linear schemes=     0.0000        0.10000+101    0.10000+101    0.10000+101
 intlbfgs> interpolation using closest constraints
 checkrep> number of active repulsions and total=      11      11
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.3956115552        0.7681234562    
 intlbfgs> largest atomic distance between images is     0.2354200207     for atom      7 and images      2     3 total images=     1
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.3955285241        0.1110223025E-13
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:      8   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.8655835841E-02         8     3
 intlbfgs> Choosing new active atom        2 new constraints=       4 maximum constraints available and possible=       5       4 shortest constraint=        2.04488
 intlbfgs> New active atom      2 closest average distances in endpoints:
     3     4     7     1     8    12    13    11
 intlbfgs> sorted average distances:
   2.045       2.169       2.581       2.625       2.659       2.698       2.708       2.749    
 intlbfgs> New active atom is number      2 total=     9 steps=     9
 intlbfgs> New active atom      2 is constrained to      4 other active atoms:
     3     7     1     8
 intlbfgs> sorted distances:
   2.045       2.581       2.625       2.659    
 intlbfgs> Turning on constraint     12 for atoms      2     3
 intlbfgs> Turning on constraint     14 for atoms      2     7
 intlbfgs> Turning on constraint      1 for atoms      1     2
 intlbfgs> Turning on constraint     15 for atoms      2     8
 intlbfgs> initial guess from closest three constrained active atoms,      3     7     1
 checkrep> number of active repulsions and total=      15      15
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.4062861377         1.336615440    
 intlbfgs> energies for constrained, preserved, closest, and linear schemes=     0.0000        0.10000+101    0.10000+101    0.10000+101
 intlbfgs> interpolation using closest constraints
 checkrep> number of active repulsions and total=      15      15
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.4062861377         1.336615440    
 intlbfgs> largest atomic distance between images is     0.2354200207     for atom      7 and images      1     2 total images=     1
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.3999870719        0.1665334537E-13
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:      9   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.7147207970E-01         9     3
 intlbfgs> Mean deviation     0.1665334537E-13 Decreasing QCI force constant to      2.940888148    
 intlbfgs> Choosing new active atom        6 new constraints=       6 maximum constraints available and possible=       6       6 shortest constraint=        2.25535
 intlbfgs> New active atom      6 closest average distances in endpoints:
     2     4    11    13    12     3     7     1     8
 intlbfgs> sorted average distances:
   2.255       3.229       3.299       3.416       4.161       4.298       4.716       4.802       4.813    
 intlbfgs> New active atom is number      6 total=    10 steps=    10
 intlbfgs> New active atom      6 is constrained to      6 other active atoms:
     2    11    12     3     1     8
 intlbfgs> sorted distances:
   2.255       3.299       4.161       4.298       4.802       4.813    
 intlbfgs> Turning on constraint     13 for atoms      2     6
 intlbfgs> Turning on constraint     34 for atoms      6    11
 intlbfgs> Turning on constraint     35 for atoms      6    12
 intlbfgs> Turning on constraint     20 for atoms      3     6
 intlbfgs> Turning on constraint      5 for atoms      1     6
 intlbfgs> Turning on constraint     32 for atoms      6     8
 intlbfgs> initial guess from closest three constrained active atoms,      2    11    12
 checkrep> number of active repulsions and total=      18      18
 congrad> Highest constraint for image      2 con     37 atoms      6    15 value=     0.0000     d,ref,cutoff=     1.2582         1.0143        0.20031     max grad=     0.0000    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.5040335413         11.60579746    
 intlbfgs> energies for constrained, preserved, closest, and linear schemes=     0.0000        0.10000+101    0.10000+101    0.10000+101
 intlbfgs> interpolation using closest constraints
 checkrep> number of active repulsions and total=      18      18
 congrad> Highest constraint for image      2 con     37 atoms      6    15 value=     0.0000     d,ref,cutoff=     1.2582         1.0143        0.20031     max grad=     0.0000    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.5040335413         11.60579746    
 intlbfgs> largest atomic distance between images is     0.2354200207     for atom      7 and images      1     2 total images=     1
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.4245983902         5.144229422    
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:     10   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.2888882256            10     3
 intlbfgs> Choosing new active atom        9 new constraints=       6 maximum constraints available and possible=       6       6 shortest constraint=        1.01331
 intlbfgs> New active atom      9 closest average distances in endpoints:
     6     2    11    13     4    12     3     1     7     8
 intlbfgs> sorted average distances:
   1.013       2.850       3.050       3.129       3.140       4.145       4.847       5.208       5.226       5.490    
 intlbfgs> New active atom is number      9 total=    11 steps=    11
 intlbfgs> New active atom      9 is constrained to      6 other active atoms:
     6     2     3     1     7     8
 intlbfgs> sorted distances:
   1.013       2.850       4.847       5.208       5.226       5.490    
 intlbfgs> Turning on constraint     33 for atoms      6     9
 intlbfgs> Turning on constraint     16 for atoms      2     9
 intlbfgs> Turning on constraint     23 for atoms      3     9
 intlbfgs> Turning on constraint      8 for atoms      1     9
 intlbfgs> Turning on constraint     39 for atoms      7     9
 intlbfgs> Turning on constraint     41 for atoms      8     9
 intlbfgs> initial guess from closest three constrained active atoms,      6     2     3
 checkrep> number of active repulsions and total=      22      22
 congrad> Highest repulsion  for image      2 ind     20 atoms     11     9 value=    0.38268E-03 d,cutoff=     2.9502         2.9836     max grad=    0.17753E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.5095340422         17.28137254    
 intlbfgs> energies for constrained, preserved, closest, and linear schemes=    0.38268E-03    0.10000+101    0.10000+101    0.10000+101
 intlbfgs> interpolation using closest constraints
 checkrep> number of active repulsions and total=      22      22
 congrad> Highest repulsion  for image      2 ind     20 atoms     11     9 value=    0.38268E-03 d,cutoff=     2.9502         2.9836     max grad=    0.17753E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.5095340422         17.28137254    
 intlbfgs> largest atomic distance between images is     0.2354200207     for atom      7 and images      2     3 total images=     1
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.4508133497         5.028727406    
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:     11   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.2604662351            11     3
 intlbfgs> Choosing new active atom       14 new constraints=       4 maximum constraints available and possible=       6       4 shortest constraint=        1.01351
 intlbfgs> New active atom     14 closest average distances in endpoints:
     6     9     2     4    13    11     3    12     8     1
 intlbfgs> sorted average distances:
   1.014       1.620       2.766       3.982       4.021       4.190       4.735       4.890       5.096       5.203    
 intlbfgs> New active atom is number     14 total=    12 steps=    12
 intlbfgs> New active atom     14 is constrained to      4 other active atoms:
     6     9     2     3
 intlbfgs> sorted distances:
   1.014       1.620       2.766       4.735    
 intlbfgs> Turning on constraint     36 for atoms      6    14
 intlbfgs> Turning on constraint     43 for atoms      9    14
 intlbfgs> Turning on constraint     17 for atoms      2    14
 intlbfgs> Turning on constraint     25 for atoms      3    14
 intlbfgs> initial guess from closest three constrained active atoms,      6     9     2
 checkrep> number of active repulsions and total=      29      29
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.5774593184         12.49416045    
 intlbfgs> energies for constrained, preserved, closest, and linear schemes=     0.0000        0.10000+101    0.10000+101    0.10000+101
 intlbfgs> interpolation using closest constraints
 checkrep> number of active repulsions and total=      29      29
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.5774593184         12.49416045    
 intlbfgs> largest atomic distance between images is     0.3554217973     for atom     14 and images      2     3 total images=     1
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.5710314215        0.8624590938E-01
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:     12   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.1115600480            12     3
 intlbfgs> Choosing new active atom       15 new constraints=       7 maximum constraints available and possible=       7       7 shortest constraint=        1.01427
 intlbfgs> New active atom     15 closest average distances in endpoints:
     6    14     9     2    11     4    13    12     3     7
 intlbfgs> sorted average distances:
   1.014       1.621       1.623       2.796       3.693       3.817       4.168       4.705       4.753       5.013    
 intlbfgs> New active atom is number     15 total=    13 steps=    13
 intlbfgs> New active atom     15 is constrained to      7 other active atoms:
     6    14     9     2    13     3     1
 intlbfgs> sorted distances:
   1.014       1.621       1.623       2.796       4.168       4.753       5.398    
 intlbfgs> Turning on constraint     37 for atoms      6    15
 intlbfgs> Turning on constraint     49 for atoms     14    15
 intlbfgs> Turning on constraint     44 for atoms      9    15
 intlbfgs> Turning on constraint     18 for atoms      2    15
 intlbfgs> Turning on constraint     48 for atoms     13    15
 intlbfgs> Turning on constraint     26 for atoms      3    15
 intlbfgs> Turning on constraint     11 for atoms      1    15
 intlbfgs> initial guess from closest three constrained active atoms,      6    14     9
 checkrep> number of active repulsions and total=      34      34
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.6215937724         1.103710412    
 intlbfgs> energies for constrained, preserved, closest, and linear schemes=     0.0000        0.10000+101    0.10000+101    0.10000+101
 intlbfgs> interpolation using closest constraints
 checkrep> number of active repulsions and total=      34      34
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.6215937724         1.103710412    
 intlbfgs> largest atomic distance between images is     0.3547661805     for atom     14 and images      1     2 total images=     1
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.6205392229        0.2587520858E-03
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:     13   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.3683720321E-01        13     3
 intlbfgs> Choosing new active atom        5 new constraints=       4 maximum constraints available and possible=       4       4 shortest constraint=        2.51981
 intlbfgs> New active atom      5 closest average distances in endpoints:
     2     8     3     6    14    15     7     1     9     4
 intlbfgs> sorted average distances:
   1.591       2.520       2.550       2.760       2.936       2.983       3.087       3.419       3.657       3.736    
 intlbfgs> New active atom is number      5 total=    14 steps=    14
 intlbfgs> New active atom      5 is constrained to      4 other active atoms:
     8     3     1    13
 intlbfgs> sorted distances:
   2.520       2.550       3.419       4.278    
 intlbfgs> Turning on constraint     30 for atoms      5     8
 intlbfgs> Turning on constraint     19 for atoms      3     5
 intlbfgs> Turning on constraint      4 for atoms      1     5
 intlbfgs> Turning on constraint     31 for atoms      5    13
 intlbfgs> initial guess from closest three constrained active atoms,      8     3     1
 checkrep> number of active repulsions and total=      43      43
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.6474234976         3.552290990    
 intlbfgs> energies for constrained, preserved, closest, and linear schemes=     0.0000        0.10000+101    0.10000+101    0.10000+101
 intlbfgs> interpolation using closest constraints
 checkrep> number of active repulsions and total=      43      43
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.6474234976         3.552290990    
 intlbfgs> largest atomic distance between images is     0.3547490274     for atom     14 and images      1     2 total images=     1
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.6278243020        0.5277774812E-05
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:     14   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.1597584297            14     3
 intlbfgs> Mean deviation     0.5277774812E-05 Decreasing QCI force constant to      2.911770444    
 intlbfgs> Choosing new active atom       10 new constraints=       1 maximum constraints available and possible=       1       1 shortest constraint=        3.39112
 intlbfgs> New active atom     10 closest average distances in endpoints:
     5     2     3     8     6    14     1     4     7    15
 intlbfgs> sorted average distances:
   1.422       1.575       2.501       2.576       2.856       2.918       2.942       3.373       3.391       3.432    
 intlbfgs> New active atom is number     10 total=    15 steps=    15
 intlbfgs> New active atom     10 is constrained to      1 other active atoms:
     7
 intlbfgs> sorted distances:
   3.391    
 intlbfgs> Turning on constraint     40 for atoms      7    10
 intlbfgs> choosing positions      1     2     3 in closest list
 checkrep> number of active repulsions and total=      56      56
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.54371E-02 d,cutoff=     2.7544         2.8733     max grad=    0.11259    
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8815784567        0.1112936979    
 intlbfgs> energies for constrained, preserved, closest, and linear schemes=    0.10000+101    0.10000+101    0.84562E-02    0.10000+101
 intlbfgs> lowest energy from interpolation using closest atoms
 checkrep> number of active repulsions and total=      56      56
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.54371E-02 d,cutoff=     2.7544         2.8733     max grad=    0.11259    
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8815784567        0.1112936979    
 intlbfgs> largest atomic distance between images is     0.6181998929     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.24820E-02 d,cutoff=     2.7922         2.8733     max grad=    0.10865    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813662009        0.4219766034E-01
 intlbfgs> Highest image        2 energy     0.5506958072E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     15   -0.1000000000+201    0.2482000872E-02   -0.1000000000+201    0.1086491467        0.4184675254E-01        15     3
 intlbfgs> switch on true potential at step     15 fraction=    0.000000 images=     1 time=    0.2633000000E-02
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> Allowing   1000 further optimization steps
 intlbfgs> largest atomic distance between images is     0.6181919695     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.25029E-02 d,cutoff=     2.7919         2.8733     max grad=    0.10859    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823238186        0.4891284766E-01
 intlbfgs> Highest QCI image energy=    0.5521734673E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5521734673E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     16   -0.1000000000+201    0.2502917853E-02   -0.1000000000+201    0.1085869176        0.4125576478E-01        15     3
 intlbfgs> largest atomic distance between images is     0.6209117051     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.61114E-02 d,cutoff=     2.7474         2.8733     max grad=    0.12491    
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8818713061        0.6335641514E-01
 intlbfgs> Highest QCI image energy=    0.9252071997E-02 images=       1
 intlbfgs> Highest image        2 energy     0.9252071997E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     17   -0.1000000000+201    0.6111441679E-02   -0.1000000000+201    0.1249054583        0.6950492511E-01        15     3
 intlbfgs> largest atomic distance between images is     0.6277101162     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     50 atoms      8    10 value=    0.49940E-02 d,cutoff=     2.4275         2.5279     max grad=    0.15121    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8950414749        0.5713624132    
 intlbfgs> Highest QCI image energy=    0.9624820165E-02 images=       1
 intlbfgs> Highest image        2 energy     0.9624820165E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     18   -0.1000000000+201    0.4993965095E-02   -0.1000000000+201    0.1512102739        0.1728696460            15     3
 intlbfgs> largest atomic distance between images is     0.6189103799     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.30644E-02 d,cutoff=     2.7834         2.8733     max grad=    0.11080    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812838412        0.8750950298E-01
 intlbfgs> Highest QCI image energy=    0.6134860528E-02 images=       1
 intlbfgs> Highest image        2 energy     0.6134860528E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     19   -0.1000000000+201    0.3064356005E-02   -0.1000000000+201    0.1107970598        0.1548223988            15     3
 intlbfgs> Mean deviation     0.8750950298E-01 Decreasing QCI force constant to      2.882941033    
 intlbfgs> largest atomic distance between images is     0.6186896239     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.33443E-02 d,cutoff=     2.7795         2.8733     max grad=    0.10833    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8811982637        0.3755532988E-01
 intlbfgs> Highest QCI image energy=    0.6292857693E-02 images=       1
 intlbfgs> Highest image        2 energy     0.6292857693E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     20   -0.1000000000+201    0.3344267310E-02   -0.1000000000+201    0.1083343433        0.1272427125E-01        15     3
 intlbfgs> largest atomic distance between images is     0.6180733928     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.32484E-02 d,cutoff=     2.7808         2.8733     max grad=    0.11075    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8811305004        0.6134862085E-01
 intlbfgs> Highest QCI image energy=    0.6297942641E-02 images=       1
 intlbfgs> Highest image        2 energy     0.6297942641E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     21   -0.1000000000+201    0.3248440509E-02   -0.1000000000+201    0.1107543403        0.1044051855E-01        15     3
 intlbfgs> largest atomic distance between images is     0.6181130518     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.32379E-02 d,cutoff=     2.7809         2.8733     max grad=    0.10880    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8811519980        0.6649949623E-01
 intlbfgs> Highest QCI image energy=    0.6188133714E-02 images=       1
 intlbfgs> Highest image        2 energy     0.6188133714E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     22   -0.1000000000+201    0.3237946173E-02   -0.1000000000+201    0.1087953867        0.7285479759E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6180830531     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.32428E-02 d,cutoff=     2.7809         2.8733     max grad=    0.10981    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8811407332        0.6437749546E-01
 intlbfgs> Highest QCI image energy=    0.6244900917E-02 images=       1
 intlbfgs> Highest image        2 energy     0.6244900917E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     23   -0.1000000000+201    0.3242816012E-02   -0.1000000000+201    0.1098074277        0.2978532896E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6180838166     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.32427E-02 d,cutoff=     2.7809         2.8733     max grad=    0.10981    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8811407165        0.6442329557E-01
 intlbfgs> Highest QCI image energy=    0.6244983815E-02 images=       1
 intlbfgs> Highest image        2 energy     0.6244983815E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     24   -0.1000000000+201    0.3242718593E-02   -0.1000000000+201    0.1098070559        0.9236616503E-05        15     3
 intlbfgs> Mean deviation     0.6442329557E-01 Decreasing QCI force constant to      2.854397063    
 intlbfgs> largest atomic distance between images is     0.6180842700     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.32425E-02 d,cutoff=     2.7809         2.8733     max grad=    0.10981    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8811407203        0.6446985354E-01
 intlbfgs> Highest QCI image energy=    0.6244963373E-02 images=       1
 intlbfgs> Highest image        2 energy     0.6244963373E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     25   -0.1000000000+201    0.3242540087E-02   -0.1000000000+201    0.1098075857        0.5622189503E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6346154957     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     45 atoms      2    10 value=    0.10848E-01 d,cutoff=     1.4252         1.5126     max grad=    0.22008    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.9035828209         1.638236633    
 intlbfgs> Highest QCI image energy=    0.1467770202E-01 images=       1
 intlbfgs> Highest image        2 energy     0.1467770202E-01 is      0.000000000     sigma from the mean
 intlbfgs> steps:     26   -0.1000000000+201    0.1084761673E-01   -0.1000000000+201    0.2200763553         1.469412928            15     3
 intlbfgs> largest atomic distance between images is     0.6180849085     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.32424E-02 d,cutoff=     2.7809         2.8733     max grad=    0.10981    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8811407252        0.6453360954E-01
 intlbfgs> Highest QCI image energy=    0.6244936748E-02 images=       1
 intlbfgs> Highest image        2 energy     0.6244936748E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     27   -0.1000000000+201    0.3242431491E-02   -0.1000000000+201    0.1098061169        0.1999935928            15     3
 intlbfgs> largest atomic distance between images is     0.6180846328     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.32423E-02 d,cutoff=     2.7809         2.8733     max grad=    0.10981    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8811407247        0.6450724730E-01
 intlbfgs> Highest QCI image energy=    0.6244939886E-02 images=       1
 intlbfgs> Highest image        2 energy     0.6244939886E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     28   -0.1000000000+201    0.3242312050E-02   -0.1000000000+201    0.1098093244        0.2383967777E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6180846703     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.32423E-02 d,cutoff=     2.7809         2.8733     max grad=    0.10981    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8811407251        0.6451131985E-01
 intlbfgs> Highest QCI image energy=    0.6244937644E-02 images=       1
 intlbfgs> Highest image        2 energy     0.6244937644E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     29   -0.1000000000+201    0.3242331127E-02   -0.1000000000+201    0.1098088524        0.2839081270E-06        15     3
 intlbfgs> Mean deviation     0.6451131985E-01 Decreasing QCI force constant to      2.826135706    
 intlbfgs> largest atomic distance between images is     0.6180918051     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.32281E-02 d,cutoff=     2.7811         2.8733     max grad=    0.10919    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8811500775        0.6469207187E-01
 intlbfgs> Highest QCI image energy=    0.6197691978E-02 images=       1
 intlbfgs> Highest image        2 energy     0.6197691978E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     30   -0.1000000000+201    0.3228120011E-02   -0.1000000000+201    0.1091878956        0.2238288755E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6180477469     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.31164E-02 d,cutoff=     2.7826         2.8733     max grad=    0.10491    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812196947        0.6051522307E-01
 intlbfgs> Highest QCI image energy=    0.5862356268E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5862356268E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     31   -0.1000000000+201    0.3116398970E-02   -0.1000000000+201    0.1049140416        0.1735206018E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6180862989     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.32162E-02 d,cutoff=     2.7812         2.8733     max grad=    0.10874    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8811571967        0.6421288835E-01
 intlbfgs> Highest QCI image energy=    0.6162090148E-02 images=       1
 intlbfgs> Highest image        2 energy     0.6162090148E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     32   -0.1000000000+201    0.3216174875E-02   -0.1000000000+201    0.1087421067        0.1551493478E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6180862163     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.32161E-02 d,cutoff=     2.7812         2.8733     max grad=    0.10874    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8811571909        0.6420543594E-01
 intlbfgs> Highest QCI image energy=    0.6162119307E-02 images=       1
 intlbfgs> Highest image        2 energy     0.6162119307E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     33   -0.1000000000+201    0.3216134388E-02   -0.1000000000+201    0.1087430677        0.1079862257E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6180861699     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.32161E-02 d,cutoff=     2.7812         2.8733     max grad=    0.10874    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8811571910        0.6420022473E-01
 intlbfgs> Highest QCI image energy=    0.6162118803E-02 images=       1
 intlbfgs> Highest image        2 energy     0.6162118803E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     34   -0.1000000000+201    0.3216111822E-02   -0.1000000000+201    0.1087432943        0.5689360248E-06        15     3
 intlbfgs> Mean deviation     0.6420022473E-01 Decreasing QCI force constant to      2.798154164    
 intlbfgs> largest atomic distance between images is     0.6180861614     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.32161E-02 d,cutoff=     2.7812         2.8733     max grad=    0.10874    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8811571910        0.6419943888E-01
 intlbfgs> Highest QCI image energy=    0.6162118970E-02 images=       1
 intlbfgs> Highest image        2 energy     0.6162118970E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     35   -0.1000000000+201    0.3216112331E-02   -0.1000000000+201    0.1087432917        0.2405915168E-07        15     3
 intlbfgs> largest atomic distance between images is     0.6180815639     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.32164E-02 d,cutoff=     2.7812         2.8733     max grad=    0.10874    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8811571936        0.6377229573E-01
 intlbfgs> Highest QCI image energy=    0.6162118657E-02 images=       1
 intlbfgs> Highest image        2 energy     0.6162118657E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     36   -0.1000000000+201    0.3216358333E-02   -0.1000000000+201    0.1087407239        0.1309223554E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6180861364     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.32161E-02 d,cutoff=     2.7812         2.8733     max grad=    0.10874    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8811571911        0.6419812276E-01
 intlbfgs> Highest QCI image energy=    0.6162118583E-02 images=       1
 intlbfgs> Highest image        2 energy     0.6162118583E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     37   -0.1000000000+201    0.3216104908E-02   -0.1000000000+201    0.1087434515        0.1305226823E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6180861569     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.32161E-02 d,cutoff=     2.7812         2.8733     max grad=    0.10874    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8811571911        0.6420008203E-01
 intlbfgs> Highest QCI image energy=    0.6162118210E-02 images=       1
 intlbfgs> Highest image        2 energy     0.6162118210E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     38   -0.1000000000+201    0.3216104970E-02   -0.1000000000+201    0.1087434290        0.5395827304E-07        15     3
 intlbfgs> largest atomic distance between images is     0.6180906157     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.32159E-02 d,cutoff=     2.7812         2.8733     max grad=    0.10874    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8811572231        0.6462473621E-01
 intlbfgs> Highest QCI image energy=    0.6161947213E-02 images=       1
 intlbfgs> Highest image        2 energy     0.6161947213E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     39   -0.1000000000+201    0.3215949077E-02   -0.1000000000+201    0.1087403416        0.1189599329E-04        15     3
 intlbfgs> Mean deviation     0.6462473621E-01 Decreasing QCI force constant to      2.770449667    
 intlbfgs> largest atomic distance between images is     0.6180898687     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.31975E-02 d,cutoff=     2.7815         2.8733     max grad=    0.10770    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8811720604        0.6375145782E-01
 intlbfgs> Highest QCI image energy=    0.6088750976E-02 images=       1
 intlbfgs> Highest image        2 energy     0.6088750976E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     40   -0.1000000000+201    0.3197549661E-02   -0.1000000000+201    0.1077016516        0.3502602320E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6180843761     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.31839E-02 d,cutoff=     2.7817         2.8733     max grad=    0.10755    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8811764960        0.6356387711E-01
 intlbfgs> Highest QCI image energy=    0.6067086947E-02 images=       1
 intlbfgs> Highest image        2 energy     0.6067086947E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     41   -0.1000000000+201    0.3183855069E-02   -0.1000000000+201    0.1075482090        0.1599484769E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6180870774     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.31893E-02 d,cutoff=     2.7816         2.8733     max grad=    0.10771    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8811735765        0.6388978560E-01
 intlbfgs> Highest QCI image energy=    0.6081312115E-02 images=       1
 intlbfgs> Highest image        2 energy     0.6081312115E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     42   -0.1000000000+201    0.3189297479E-02   -0.1000000000+201    0.1077144855        0.7250599616E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6180879393     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.31898E-02 d,cutoff=     2.7816         2.8733     max grad=    0.10767    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8811739028        0.6390203113E-01
 intlbfgs> Highest QCI image energy=    0.6079717837E-02 images=       1
 intlbfgs> Highest image        2 energy     0.6079717837E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     43   -0.1000000000+201    0.3189802946E-02   -0.1000000000+201    0.1076743195        0.1484431582E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6180877022     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.31896E-02 d,cutoff=     2.7816         2.8733     max grad=    0.10768    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8811738906        0.6389523740E-01
 intlbfgs> Highest QCI image energy=    0.6079777405E-02 images=       1
 intlbfgs> Highest image        2 energy     0.6079777405E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     44   -0.1000000000+201    0.3189557268E-02   -0.1000000000+201    0.1076802451        0.3578875345E-05        15     3
 intlbfgs> Mean deviation     0.6389523740E-01 Decreasing QCI force constant to      2.743019473    
 intlbfgs> largest atomic distance between images is     0.6180877198     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.31896E-02 d,cutoff=     2.7816         2.8733     max grad=    0.10768    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8811738878        0.6389716492E-01
 intlbfgs> Highest QCI image energy=    0.6079791263E-02 images=       1
 intlbfgs> Highest image        2 energy     0.6079791263E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     45   -0.1000000000+201    0.3189564908E-02   -0.1000000000+201    0.1076803778        0.1433821865E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6180877399     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.31896E-02 d,cutoff=     2.7816         2.8733     max grad=    0.10768    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8811738906        0.6389898299E-01
 intlbfgs> Highest QCI image energy=    0.6079777400E-02 images=       1
 intlbfgs> Highest image        2 energy     0.6079777400E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     46   -0.1000000000+201    0.3189567010E-02   -0.1000000000+201    0.1076800918        0.1669827467E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6180875776     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.31850E-02 d,cutoff=     2.7817         2.8733     max grad=    0.10728    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8811791575        0.6358606107E-01
 intlbfgs> Highest QCI image energy=    0.6054161980E-02 images=       1
 intlbfgs> Highest image        2 energy     0.6054161980E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     47   -0.1000000000+201    0.3184986917E-02   -0.1000000000+201    0.1072824751        0.1277882136E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6180852673     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.31784E-02 d,cutoff=     2.7818         2.8733     max grad=    0.10715    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8811819509        0.6339098993E-01
 intlbfgs> Highest QCI image energy=    0.6040626526E-02 images=       1
 intlbfgs> Highest image        2 energy     0.6040626526E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     48   -0.1000000000+201    0.3178379694E-02   -0.1000000000+201    0.1071485073        0.7872636836E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6180862029     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.31764E-02 d,cutoff=     2.7818         2.8733     max grad=    0.10714    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8811823674        0.6351266157E-01
 intlbfgs> Highest QCI image energy=    0.6038606436E-02 images=       1
 intlbfgs> Highest image        2 energy     0.6038606436E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     49   -0.1000000000+201    0.3176350588E-02   -0.1000000000+201    0.1071448888        0.2672307620E-04        15     3
 intlbfgs> Mean deviation     0.6351266157E-01 Decreasing QCI force constant to      2.715860864    
 intlbfgs> largest atomic distance between images is     0.6180879688     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.31762E-02 d,cutoff=     2.7818         2.8733     max grad=    0.10715    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8811823255        0.6369446751E-01
 intlbfgs> Highest QCI image energy=    0.6038803938E-02 images=       1
 intlbfgs> Highest image        2 energy     0.6038803938E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     50   -0.1000000000+201    0.3176246852E-02   -0.1000000000+201    0.1071491412        0.6128624183E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6181150541     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.31731E-02 d,cutoff=     2.7818         2.8733     max grad=    0.10717    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8811824327        0.6647487535E-01
 intlbfgs> Highest QCI image energy=    0.6038238562E-02 images=       1
 intlbfgs> Highest image        2 energy     0.6038238562E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     51   -0.1000000000+201    0.3173080210E-02   -0.1000000000+201    0.1071745330        0.9921964916E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6180890965     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.31754E-02 d,cutoff=     2.7818         2.8733     max grad=    0.10715    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8811824172        0.6382709903E-01
 intlbfgs> Highest QCI image energy=    0.6038357576E-02 images=       1
 intlbfgs> Highest image        2 energy     0.6038357576E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     52   -0.1000000000+201    0.3175444218E-02   -0.1000000000+201    0.1071546248        0.8991735284E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6180867018     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.31756E-02 d,cutoff=     2.7818         2.8733     max grad=    0.10715    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8811825038        0.6358692738E-01
 intlbfgs> Highest QCI image energy=    0.6037945531E-02 images=       1
 intlbfgs> Highest image        2 energy     0.6037945531E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     53   -0.1000000000+201    0.3175558821E-02   -0.1000000000+201    0.1071459101        0.7308165116E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6180612346     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.31747E-02 d,cutoff=     2.7818         2.8733     max grad=    0.10700    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8811844890        0.6099751502E-01
 intlbfgs> Highest QCI image energy=    0.6028445502E-02 images=       1
 intlbfgs> Highest image        2 energy     0.6028445502E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     54   -0.1000000000+201    0.3174660419E-02   -0.1000000000+201    0.1069953109        0.8479257045E-04        15     3
 intlbfgs> Mean deviation     0.6099751502E-01 Decreasing QCI force constant to      2.688971153    
 intlbfgs> largest atomic distance between images is     0.6181062013     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.31622E-02 d,cutoff=     2.7820         2.8733     max grad=    0.10653    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8811918006        0.6505613042E-01
 intlbfgs> Highest QCI image energy=    0.5993221675E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5993221675E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     55   -0.1000000000+201    0.3162207904E-02   -0.1000000000+201    0.1065284712        0.2034426325E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6207495620     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.23492E-02 d,cutoff=     2.7944         2.8733     max grad=    0.72777E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8818361205        0.2924928223    
 intlbfgs> Highest QCI image energy=    0.3802103862E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3802103862E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     56   -0.1000000000+201    0.2349178548E-02   -0.1000000000+201    0.7277705452E-01    0.1395899454E-01        15     3
 intlbfgs> largest atomic distance between images is     0.6181259284     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.31507E-02 d,cutoff=     2.7822         2.8733     max grad=    0.10613    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8811983875        0.6680793996E-01
 intlbfgs> Highest QCI image energy=    0.5961818942E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5961818942E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     57   -0.1000000000+201    0.3150728570E-02   -0.1000000000+201    0.1061314662        0.1379569517E-01        15     3
 intlbfgs> largest atomic distance between images is     0.6181180700     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.31504E-02 d,cutoff=     2.7822         2.8733     max grad=    0.10613    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8811985546        0.6609134370E-01
 intlbfgs> Highest QCI image energy=    0.5961038169E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5961038169E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     58   -0.1000000000+201    0.3150356235E-02   -0.1000000000+201    0.1061284745        0.1926925841E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6180896264     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.31498E-02 d,cutoff=     2.7822         2.8733     max grad=    0.10608    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8811993529        0.6339627094E-01
 intlbfgs> Highest QCI image energy=    0.5957312935E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5957312935E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     59   -0.1000000000+201    0.3149821026E-02   -0.1000000000+201    0.1060835587        0.7181040253E-04        15     3
 intlbfgs> Mean deviation     0.6339627094E-01 Decreasing QCI force constant to      2.662347676    
 intlbfgs> largest atomic distance between images is     0.6180892822     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.31494E-02 d,cutoff=     2.7822         2.8733     max grad=    0.10609    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8811993541        0.6337286220E-01
 intlbfgs> Highest QCI image energy=    0.5957308106E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5957308106E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     60   -0.1000000000+201    0.3149443300E-02   -0.1000000000+201    0.1060911573        0.4688789129E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6185210150     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     45 atoms      2    10 value=    0.30959E-02 d,cutoff=     1.4650         1.5126     max grad=    0.12601    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812990251        0.9922741448E-03
 intlbfgs> Highest QCI image energy=    0.6155001819E-02 images=       1
 intlbfgs> Highest image        2 energy     0.6155001819E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     61   -0.1000000000+201    0.3095937437E-02   -0.1000000000+201    0.1260073601        0.1250869352E-01        15     3
 intlbfgs> largest atomic distance between images is     0.6180891520     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.31492E-02 d,cutoff=     2.7822         2.8733     max grad=    0.10610    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8811993600        0.6336810596E-01
 intlbfgs> Highest QCI image energy=    0.5957280493E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5957280493E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     62   -0.1000000000+201    0.3149170024E-02   -0.1000000000+201    0.1060960759        0.1250532209E-01        15     3
 intlbfgs> largest atomic distance between images is     0.6180891531     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.31492E-02 d,cutoff=     2.7822         2.8733     max grad=    0.10610    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8811993630        0.6336837267E-01
 intlbfgs> Highest QCI image energy=    0.5957266269E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5957266269E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     63   -0.1000000000+201    0.3149165742E-02   -0.1000000000+201    0.1060958810        0.9857931273E-07        15     3
 intlbfgs> largest atomic distance between images is     0.6180935945     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.31384E-02 d,cutoff=     2.7823         2.8733     max grad=    0.10563    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812066862        0.6375410747E-01
 intlbfgs> Highest QCI image energy=    0.5922707236E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5922707236E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     64   -0.1000000000+201    0.3138372304E-02   -0.1000000000+201    0.1056319644        0.1851356040E-03        15     3
 intlbfgs> Mean deviation     0.6375410747E-01 Decreasing QCI force constant to      2.635987798    
 intlbfgs> largest atomic distance between images is     0.6180932952     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.31364E-02 d,cutoff=     2.7824         2.8733     max grad=    0.10556    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812078900        0.6350533567E-01
 intlbfgs> Highest QCI image energy=    0.5917052219E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5917052219E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     65   -0.1000000000+201    0.3136367933E-02   -0.1000000000+201    0.1055612392        0.5079880016E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6180897803     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.31353E-02 d,cutoff=     2.7824         2.8733     max grad=    0.10557    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812081245        0.6232595675E-01
 intlbfgs> Highest QCI image energy=    0.5916126299E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5916126299E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     66   -0.1000000000+201    0.3135343819E-02   -0.1000000000+201    0.1055651057        0.2108928409E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6180939998     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.31364E-02 d,cutoff=     2.7824         2.8733     max grad=    0.10555    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812079750        0.6351089583E-01
 intlbfgs> Highest QCI image energy=    0.5916653701E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5916653701E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     67   -0.1000000000+201    0.3136414699E-02   -0.1000000000+201    0.1055524231        0.1997635312E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6180936089     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.31361E-02 d,cutoff=     2.7824         2.8733     max grad=    0.10556    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812079982        0.6349272893E-01
 intlbfgs> Highest QCI image energy=    0.5916544998E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5916544998E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     68   -0.1000000000+201    0.3136054570E-02   -0.1000000000+201    0.1055576650        0.5155813111E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6180895933     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.31333E-02 d,cutoff=     2.7824         2.8733     max grad=    0.10558    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812083085        0.6321554989E-01
 intlbfgs> Highest QCI image energy=    0.5915099884E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5915099884E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     69   -0.1000000000+201    0.3133321026E-02   -0.1000000000+201    0.1055848699        0.3229491780E-04        15     3
 intlbfgs> Mean deviation     0.6321554989E-01 Decreasing QCI force constant to      2.609888909    
 intlbfgs> largest atomic distance between images is     0.6180995662     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.31196E-02 d,cutoff=     2.7826         2.8733     max grad=    0.10477    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812201254        0.6374563816E-01
 intlbfgs> Highest QCI image energy=    0.5860037876E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5860037876E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     70   -0.1000000000+201    0.3119568078E-02   -0.1000000000+201    0.1047691431        0.2732557583E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6180903653     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.30885E-02 d,cutoff=     2.7830         2.8733     max grad=    0.10365    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812393244        0.6239907430E-01
 intlbfgs> Highest QCI image energy=    0.5772193503E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5772193503E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     71   -0.1000000000+201    0.3088533991E-02   -0.1000000000+201    0.1036471898        0.4498568674E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6180924315     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.31094E-02 d,cutoff=     2.7827         2.8733     max grad=    0.10450    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812253390        0.6299009209E-01
 intlbfgs> Highest QCI image energy=    0.5835999855E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5835999855E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     72   -0.1000000000+201    0.3109446727E-02   -0.1000000000+201    0.1044972531        0.3225975362E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6180914179     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.31093E-02 d,cutoff=     2.7827         2.8733     max grad=    0.10450    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812253258        0.6289918338E-01
 intlbfgs> Highest QCI image energy=    0.5836062602E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5836062602E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     73   -0.1000000000+201    0.3109346165E-02   -0.1000000000+201    0.1045005825        0.4170934863E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6180905468     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.31094E-02 d,cutoff=     2.7827         2.8733     max grad=    0.10450    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812253220        0.6282017608E-01
 intlbfgs> Highest QCI image energy=    0.5836081973E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5836081973E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     74   -0.1000000000+201    0.3109355303E-02   -0.1000000000+201    0.1045007757        0.3687528967E-05        15     3
 intlbfgs> Mean deviation     0.6282017608E-01 Decreasing QCI force constant to      2.584048424    
 intlbfgs> largest atomic distance between images is     0.6180905461     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.31093E-02 d,cutoff=     2.7827         2.8733     max grad=    0.10450    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812253227        0.6281933215E-01
 intlbfgs> Highest QCI image energy=    0.5836078783E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5836078783E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     75   -0.1000000000+201    0.3109330860E-02   -0.1000000000+201    0.1045012526        0.4068039812E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6180902366     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.30995E-02 d,cutoff=     2.7829         2.8733     max grad=    0.10472    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812253538        0.6247337883E-01
 intlbfgs> Highest QCI image energy=    0.5836072625E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5836072625E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     76   -0.1000000000+201    0.3099487473E-02   -0.1000000000+201    0.1047186866        0.1705775620E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6180905353     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.31093E-02 d,cutoff=     2.7827         2.8733     max grad=    0.10450    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812253222        0.6281841057E-01
 intlbfgs> Highest QCI image energy=    0.5836081482E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5836081482E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     77   -0.1000000000+201    0.3109313141E-02   -0.1000000000+201    0.1045016968        0.1703248919E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6180905420     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.31093E-02 d,cutoff=     2.7827         2.8733     max grad=    0.10450    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812253228        0.6281887845E-01
 intlbfgs> Highest QCI image energy=    0.5836078699E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5836078699E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     78   -0.1000000000+201    0.3109315130E-02   -0.1000000000+201    0.1045015994        0.3895708863E-07        15     3
 intlbfgs> largest atomic distance between images is     0.6181039950     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.31112E-02 d,cutoff=     2.7827         2.8733     max grad=    0.10427    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812273631        0.6372297306E-01
 intlbfgs> Highest QCI image energy=    0.5826700553E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5826700553E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     79   -0.1000000000+201    0.3111225868E-02   -0.1000000000+201    0.1042736193        0.7743624625E-04        15     3
 intlbfgs> Mean deviation     0.6372297306E-01 Decreasing QCI force constant to      2.558463787    
 intlbfgs> largest atomic distance between images is     0.6180966353     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.30983E-02 d,cutoff=     2.7829         2.8733     max grad=    0.10402    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812330148        0.6300992297E-01
 intlbfgs> Highest QCI image energy=    0.5800850209E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5800850209E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     80   -0.1000000000+201    0.3098253043E-02   -0.1000000000+201    0.1040239112        0.1510184002E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6181151776     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.30821E-02 d,cutoff=     2.7831         2.8733     max grad=    0.10292    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812486489        0.6395455340E-01
 intlbfgs> Highest QCI image energy=    0.5730217611E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5730217611E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     81   -0.1000000000+201    0.3082136929E-02   -0.1000000000+201    0.1029249426        0.3524342936E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6180849495     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.30777E-02 d,cutoff=     2.7832         2.8733     max grad=    0.10350    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812433915        0.6190471572E-01
 intlbfgs> Highest QCI image energy=    0.5753843633E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5753843633E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     82   -0.1000000000+201    0.3077731160E-02   -0.1000000000+201    0.1035005735        0.1852729236E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6180930207     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.30843E-02 d,cutoff=     2.7831         2.8733     max grad=    0.10346    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812423072        0.6258230367E-01
 intlbfgs> Highest QCI image energy=    0.5758706679E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5758706679E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     83   -0.1000000000+201    0.3084306523E-02   -0.1000000000+201    0.1034605979        0.6969645215E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6180911774     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.30824E-02 d,cutoff=     2.7831         2.8733     max grad=    0.10344    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812429524        0.6242537848E-01
 intlbfgs> Highest QCI image energy=    0.5755799984E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5755799984E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     84   -0.1000000000+201    0.3082396465E-02   -0.1000000000+201    0.1034419813        0.2080793129E-04        15     3
 intlbfgs> Mean deviation     0.6242537848E-01 Decreasing QCI force constant to      2.533132462    
 intlbfgs> largest atomic distance between images is     0.6180908937     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.30824E-02 d,cutoff=     2.7831         2.8733     max grad=    0.10345    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812429142        0.6240626382E-01
 intlbfgs> Highest QCI image energy=    0.5755972528E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5755972528E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     85   -0.1000000000+201    0.3082414278E-02   -0.1000000000+201    0.1034451507        0.1317870241E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6180907409     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.30823E-02 d,cutoff=     2.7831         2.8733     max grad=    0.10344    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812429525        0.6239402056E-01
 intlbfgs> Highest QCI image energy=    0.5755800228E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5755800228E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     86   -0.1000000000+201    0.3082298069E-02   -0.1000000000+201    0.1034441179        0.1322576380E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6181003218     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.30677E-02 d,cutoff=     2.7833         2.8733     max grad=    0.10294    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812518291        0.6279014218E-01
 intlbfgs> Highest QCI image energy=    0.5715976646E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5715976646E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     87   -0.1000000000+201    0.3067650633E-02   -0.1000000000+201    0.1029409252        0.2062286164E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6180860297     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.30677E-02 d,cutoff=     2.7833         2.8733     max grad=    0.10293    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812519203        0.6184667013E-01
 intlbfgs> Highest QCI image energy=    0.5715581288E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5715581288E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     88   -0.1000000000+201    0.3067721020E-02   -0.1000000000+201    0.1029326859        0.7606701883E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6180909221     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.30688E-02 d,cutoff=     2.7833         2.8733     max grad=    0.10292    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812517821        0.6219097458E-01
 intlbfgs> Highest QCI image energy=    0.5716188378E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5716188378E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     89   -0.1000000000+201    0.3068822888E-02   -0.1000000000+201    0.1029210682        0.2262583103E-04        15     3
 intlbfgs> Mean deviation     0.6219097458E-01 Decreasing QCI force constant to      2.508051943    
 intlbfgs> largest atomic distance between images is     0.6180909281     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.30689E-02 d,cutoff=     2.7833         2.8733     max grad=    0.10292    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812517985        0.6218751268E-01
 intlbfgs> Highest QCI image energy=    0.5716115300E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5716115300E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     90   -0.1000000000+201    0.3068941734E-02   -0.1000000000+201    0.1029171348        0.1873096956E-05        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6180905796     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.30662E-02 d,cutoff=     2.7834         2.8733     max grad=    0.10297    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812518030        0.6222395605E-01
 intlbfgs> Highest QCI image energy=    0.5716099115E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5716099115E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     91   -0.1000000000+201    0.3066217764E-02   -0.1000000000+201    0.1029731354        0.3589097686E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6180906554     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.30688E-02 d,cutoff=     2.7833         2.8733     max grad=    0.10292    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812518137        0.6216053653E-01
 intlbfgs> Highest QCI image energy=    0.5716047782E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5716047782E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     92   -0.1000000000+201    0.3068839000E-02   -0.1000000000+201    0.1029180856        0.3515206354E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6180905294     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.30690E-02 d,cutoff=     2.7833         2.8733     max grad=    0.10291    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812518319        0.6214703700E-01
 intlbfgs> Highest QCI image energy=    0.5715967157E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5715967157E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     93   -0.1000000000+201    0.3068988444E-02   -0.1000000000+201    0.1029133735        0.2397447273E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6180874418     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.30707E-02 d,cutoff=     2.7833         2.8733     max grad=    0.10283    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812523737        0.6184889839E-01
 intlbfgs> Highest QCI image energy=    0.5713562279E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5713562279E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     94   -0.1000000000+201    0.3070712069E-02   -0.1000000000+201    0.1028293228        0.3723202890E-04        15     3
 intlbfgs> Mean deviation     0.6184889839E-01 Decreasing QCI force constant to      2.483219745    
 intlbfgs> largest atomic distance between images is     0.6180966318     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.30548E-02 d,cutoff=     2.7835         2.8733     max grad=    0.10234    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812613831        0.6233506229E-01
 intlbfgs> Highest QCI image energy=    0.5673549589E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5673549589E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     95   -0.1000000000+201    0.3054789978E-02   -0.1000000000+201    0.1023443785        0.2120117012E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6182220916     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.26756E-02 d,cutoff=     2.7892         2.8733     max grad=    0.88707E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815216728        0.6542670361E-01
 intlbfgs> Highest QCI image energy=    0.4668952943E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4668952943E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     96   -0.1000000000+201    0.2675617878E-02   -0.1000000000+201    0.8870672262E-01    0.5578402557E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6180958058     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.30417E-02 d,cutoff=     2.7837         2.8733     max grad=    0.10187    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812696790        0.6210996451E-01
 intlbfgs> Highest QCI image energy=    0.5637076459E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5637076459E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     97   -0.1000000000+201    0.3041673350E-02   -0.1000000000+201    0.1018721464        0.5387197247E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6180932495     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.30418E-02 d,cutoff=     2.7837         2.8733     max grad=    0.10187    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812696890        0.6191951890E-01
 intlbfgs> Highest QCI image energy=    0.5637035853E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5637035853E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     98   -0.1000000000+201    0.3041789202E-02   -0.1000000000+201    0.1018693761        0.1070269228E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6180907510     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.30419E-02 d,cutoff=     2.7837         2.8733     max grad=    0.10187    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812697223        0.6172709206E-01
 intlbfgs> Highest QCI image energy=    0.5636894691E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5636894691E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     99   -0.1000000000+201    0.3041876112E-02   -0.1000000000+201    0.1018651511        0.9898788358E-05        15     3
 intlbfgs> Mean deviation     0.6172709206E-01 Decreasing QCI force constant to      2.458633411    
 intlbfgs> largest atomic distance between images is     0.6180906813     for atom     10 and images      2     3 total images=     1
 checkrep> number of active repulsions and total=      56      56
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.30419E-02 d,cutoff=     2.7837         2.8733     max grad=    0.10187    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812697225        0.6172018000E-01
 intlbfgs> Highest QCI image energy=    0.5636893696E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5636893696E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    100   -0.1000000000+201    0.3041874576E-02   -0.1000000000+201    0.1018651734        0.2063117001E-06        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.6180074013     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.30405E-02 d,cutoff=     2.7837         2.8733     max grad=    0.10191    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812698048        0.5347038987E-01
 intlbfgs> Highest QCI image energy=    0.5636874159E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5636874159E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    101   -0.1000000000+201    0.3040456813E-02   -0.1000000000+201    0.1019068237        0.2467100207E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6180905746     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.30419E-02 d,cutoff=     2.7837         2.8733     max grad=    0.10187    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812697224        0.6170996069E-01
 intlbfgs> Highest QCI image energy=    0.5636894589E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5636894589E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    102   -0.1000000000+201    0.3041868398E-02   -0.1000000000+201    0.1018653337        0.2464470689E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6180905713     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.30419E-02 d,cutoff=     2.7837         2.8733     max grad=    0.10187    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812697226        0.6170980192E-01
 intlbfgs> Highest QCI image energy=    0.5636893665E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5636893665E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    103   -0.1000000000+201    0.3041865187E-02   -0.1000000000+201    0.1018653836        0.4226512082E-07        15     3
 intlbfgs> largest atomic distance between images is     0.6180876596     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.30394E-02 d,cutoff=     2.7837         2.8733     max grad=    0.10189    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812700455        0.6156008959E-01
 intlbfgs> Highest QCI image energy=    0.5635487519E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5635487519E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    104   -0.1000000000+201    0.3039379067E-02   -0.1000000000+201    0.1018897129        0.3275357676E-04        15     3
 intlbfgs> Mean deviation     0.6156008959E-01 Decreasing QCI force constant to      2.434290506    
 intlbfgs> largest atomic distance between images is     0.6181040731     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.30236E-02 d,cutoff=     2.7840         2.8733     max grad=    0.10104    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812831937        0.6245927505E-01
 intlbfgs> Highest QCI image energy=    0.5578355457E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5578355457E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    105   -0.1000000000+201    0.3023614820E-02   -0.1000000000+201    0.1010426189        0.2894728309E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6180863956     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.30007E-02 d,cutoff=     2.7843         2.8733     max grad=    0.10021    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812980995        0.6067742876E-01
 intlbfgs> Highest QCI image energy=    0.5514629864E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5514629864E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    106   -0.1000000000+201    0.3000656719E-02   -0.1000000000+201    0.1002059321        0.3492489347E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6180927819     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.30148E-02 d,cutoff=     2.7841         2.8733     max grad=    0.10081    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812878849        0.6147168399E-01
 intlbfgs> Highest QCI image energy=    0.5558194167E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5558194167E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    107   -0.1000000000+201    0.3014836523E-02   -0.1000000000+201    0.1008116490        0.2315430089E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6180913825     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.30148E-02 d,cutoff=     2.7841         2.8733     max grad=    0.10081    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812878757        0.6134470737E-01
 intlbfgs> Highest QCI image energy=    0.5558236627E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5558236627E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    108   -0.1000000000+201    0.3014760653E-02   -0.1000000000+201    0.1008142562        0.2761697023E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6180901084     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.30148E-02 d,cutoff=     2.7841         2.8733     max grad=    0.10081    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812878726        0.6122469279E-01
 intlbfgs> Highest QCI image energy=    0.5558252431E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5558252431E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    109   -0.1000000000+201    0.3014754338E-02   -0.1000000000+201    0.1008148228        0.2444526053E-05        15     3
 intlbfgs> Mean deviation     0.6122469279E-01 Decreasing QCI force constant to      2.410188620    
 intlbfgs> largest atomic distance between images is     0.6180900931     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.30147E-02 d,cutoff=     2.7841         2.8733     max grad=    0.10081    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812878738        0.6122261712E-01
 intlbfgs> Highest QCI image energy=    0.5558247688E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5558247688E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    110   -0.1000000000+201    0.3014743128E-02   -0.1000000000+201    0.1008149770        0.2092454937E-06        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6180906450     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.30151E-02 d,cutoff=     2.7841         2.8733     max grad=    0.10081    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812878742        0.6129665001E-01
 intlbfgs> Highest QCI image energy=    0.5558244382E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5558244382E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    111   -0.1000000000+201    0.3015092895E-02   -0.1000000000+201    0.1008069458        0.7630855090E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6180899417     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.30147E-02 d,cutoff=     2.7841         2.8733     max grad=    0.10082    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812878806        0.6121598486E-01
 intlbfgs> Highest QCI image energy=    0.5558218623E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5558218623E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    112   -0.1000000000+201    0.3014700562E-02   -0.1000000000+201    0.1008152599        0.7008501935E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6180893776     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.30144E-02 d,cutoff=     2.7841         2.8733     max grad=    0.10082    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812878955        0.6115763764E-01
 intlbfgs> Highest QCI image energy=    0.5558156057E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5558156057E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    113   -0.1000000000+201    0.3014381468E-02   -0.1000000000+201    0.1008210798        0.4719165993E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6180879574     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.30136E-02 d,cutoff=     2.7841         2.8733     max grad=    0.10083    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812879641        0.6101384239E-01
 intlbfgs> Highest QCI image energy=    0.5557865998E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5557865998E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    114   -0.1000000000+201    0.3013574370E-02   -0.1000000000+201    0.1008329862        0.1102336440E-04        15     3
 intlbfgs> Mean deviation     0.6101384239E-01 Decreasing QCI force constant to      2.386325366    
 intlbfgs> largest atomic distance between images is     0.6180976268     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.30016E-02 d,cutoff=     2.7843         2.8733     max grad=    0.10016    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8812984068        0.6136158690E-01
 intlbfgs> Highest QCI image energy=    0.5513319372E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5513319372E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    115   -0.1000000000+201    0.3001582029E-02   -0.1000000000+201    0.1001596918        0.2274342041E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6180837609     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.29025E-02 d,cutoff=     2.7857         2.8733     max grad=    0.96494E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813651644        0.5921132646E-01
 intlbfgs> Highest QCI image energy=    0.5240036885E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5240036885E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    116   -0.1000000000+201    0.2902543542E-02   -0.1000000000+201    0.9649415832E-01    0.1508796009E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6180908598     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.29880E-02 d,cutoff=     2.7845         2.8733     max grad=    0.99754E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813062777        0.6080059337E-01
 intlbfgs> Highest QCI image energy=    0.5480075733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5480075733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    117   -0.1000000000+201    0.2988009529E-02   -0.1000000000+201    0.9975437530E-01    0.1317460546E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6180896291     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.29877E-02 d,cutoff=     2.7845         2.8733     max grad=    0.99764E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813062513        0.6072638339E-01
 intlbfgs> Highest QCI image energy=    0.5480188213E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5480188213E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    118   -0.1000000000+201    0.2987668817E-02   -0.1000000000+201    0.9976417190E-01    0.7623950688E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6180891973     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.29875E-02 d,cutoff=     2.7845         2.8733     max grad=    0.99767E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813062470        0.6069909307E-01
 intlbfgs> Highest QCI image energy=    0.5480206949E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5480206949E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    119   -0.1000000000+201    0.2987547171E-02   -0.1000000000+201    0.9976722901E-01    0.2539023428E-05        15     3
 intlbfgs> Mean deviation     0.6069909307E-01 Decreasing QCI force constant to      2.362698382    
 intlbfgs> largest atomic distance between images is     0.6180891834     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.29875E-02 d,cutoff=     2.7845         2.8733     max grad=    0.99767E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813062470        0.6069777839E-01
 intlbfgs> Highest QCI image energy=    0.5480207086E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5480207086E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    120   -0.1000000000+201    0.2987547472E-02   -0.1000000000+201    0.9976722635E-01    0.8683052345E-07        15     3
 intlbfgs> largest atomic distance between images is     0.6179472388     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.29901E-02 d,cutoff=     2.7845         2.8733     max grad=    0.99720E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813067626        0.4732656284E-01
 intlbfgs> Highest QCI image energy=    0.5480381648E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5480381648E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    121   -0.1000000000+201    0.2990114884E-02   -0.1000000000+201    0.9972041033E-01    0.8827382747E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6180891617     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.29875E-02 d,cutoff=     2.7845         2.8733     max grad=    0.99767E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813062470        0.6069567766E-01
 intlbfgs> Highest QCI image energy=    0.5480206939E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5480206939E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    122   -0.1000000000+201    0.2987547429E-02   -0.1000000000+201    0.9976722551E-01    0.8826226440E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6180891615     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.29875E-02 d,cutoff=     2.7845         2.8733     max grad=    0.99767E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813062471        0.6069567253E-01
 intlbfgs> Highest QCI image energy=    0.5480206797E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5480206797E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    123   -0.1000000000+201    0.2987547707E-02   -0.1000000000+201    0.9976721646E-01    0.5848113778E-08        15     3
 intlbfgs> largest atomic distance between images is     0.6180870293     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.29886E-02 d,cutoff=     2.7845         2.8733     max grad=    0.99716E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813065791        0.6056018651E-01
 intlbfgs> Highest QCI image energy=    0.5478816815E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5478816815E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    124   -0.1000000000+201    0.2988557933E-02   -0.1000000000+201    0.9971607243E-01    0.2970479819E-04        15     3
 intlbfgs> Mean deviation     0.6056018651E-01 Decreasing QCI force constant to      2.339305329    
 intlbfgs> largest atomic distance between images is     0.6180972910     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.29747E-02 d,cutoff=     2.7847         2.8733     max grad=    0.99121E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813167287        0.6090946250E-01
 intlbfgs> Highest QCI image energy=    0.5436371500E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5436371500E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    125   -0.1000000000+201    0.2974676225E-02   -0.1000000000+201    0.9912095078E-01    0.2223721399E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6180821849     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.28437E-02 d,cutoff=     2.7866         2.8733     max grad=    0.94626E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814026411        0.5754895244E-01
 intlbfgs> Highest QCI image energy=    0.5094784745E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5094784745E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    126   -0.1000000000+201    0.2843739538E-02   -0.1000000000+201    0.9462611061E-01    0.1893187590E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6180899657     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.29607E-02 d,cutoff=     2.7849         2.8733     max grad=    0.98711E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813248560        0.6024410626E-01
 intlbfgs> Highest QCI image energy=    0.5402720080E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5402720080E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    127   -0.1000000000+201    0.2960728620E-02   -0.1000000000+201    0.9871129170E-01    0.1701204368E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6180883497     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.29604E-02 d,cutoff=     2.7849         2.8733     max grad=    0.98719E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813248416        0.6015441055E-01
 intlbfgs> Highest QCI image energy=    0.5402780768E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5402780768E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    128   -0.1000000000+201    0.2960416522E-02   -0.1000000000+201    0.9871944875E-01    0.1096827436E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6180878260     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.29603E-02 d,cutoff=     2.7849         2.8733     max grad=    0.98722E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813248434        0.6013305545E-01
 intlbfgs> Highest QCI image energy=    0.5402773727E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5402773727E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    129   -0.1000000000+201    0.2960284285E-02   -0.1000000000+201    0.9872214642E-01    0.4974509171E-05        15     3
 intlbfgs> Mean deviation     0.6013305545E-01 Decreasing QCI force constant to      2.316143890    
 intlbfgs> largest atomic distance between images is     0.6180878673     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.29603E-02 d,cutoff=     2.7849         2.8733     max grad=    0.98722E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813248431        0.6013699974E-01
 intlbfgs> Highest QCI image energy=    0.5402775152E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5402775152E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    130   -0.1000000000+201    0.2960274198E-02   -0.1000000000+201    0.9872238481E-01    0.1924844949E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6181059650     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.29556E-02 d,cutoff=     2.7850         2.8733     max grad=    0.98819E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813248409        0.6186168404E-01
 intlbfgs> Highest QCI image energy=    0.5402769749E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5402769749E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    131   -0.1000000000+201    0.2955610062E-02   -0.1000000000+201    0.9881867217E-01    0.8481501068E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6180879090     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.29603E-02 d,cutoff=     2.7849         2.8733     max grad=    0.98723E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813248435        0.6014096582E-01
 intlbfgs> Highest QCI image energy=    0.5402773412E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5402773412E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    132   -0.1000000000+201    0.2960261136E-02   -0.1000000000+201    0.9872262084E-01    0.8460420012E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6180878969     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.29603E-02 d,cutoff=     2.7849         2.8733     max grad=    0.98723E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813248439        0.6013982082E-01
 intlbfgs> Highest QCI image energy=    0.5402771703E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5402771703E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    133   -0.1000000000+201    0.2960261221E-02   -0.1000000000+201    0.9872258619E-01    0.4422155116E-07        15     3
 intlbfgs> largest atomic distance between images is     0.6180711604     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.29598E-02 d,cutoff=     2.7849         2.8733     max grad=    0.98624E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813261578        0.5853656228E-01
 intlbfgs> Highest QCI image energy=    0.5397402869E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5397402869E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    134   -0.1000000000+201    0.2959787649E-02   -0.1000000000+201    0.9862361471E-01    0.6845831711E-04        15     3
 intlbfgs> Mean deviation     0.5853656228E-01 Decreasing QCI force constant to      2.293211772    
 intlbfgs> largest atomic distance between images is     0.6181101478     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.29443E-02 d,cutoff=     2.7851         2.8733     max grad=    0.98006E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813369652        0.6164667500E-01
 intlbfgs> Highest QCI image energy=    0.5353093891E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5353093891E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    135   -0.1000000000+201    0.2944339347E-02   -0.1000000000+201    0.9800642394E-01    0.2560809337E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6181224124     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.28863E-02 d,cutoff=     2.7860         2.8733     max grad=    0.96027E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813747137        0.6224040711E-01
 intlbfgs> Highest QCI image energy=    0.5202437802E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5202437802E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    136   -0.1000000000+201    0.2886338722E-02   -0.1000000000+201    0.9602716173E-01    0.8459847292E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6180938638     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.29332E-02 d,cutoff=     2.7853         2.8733     max grad=    0.97675E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813436451        0.6019275433E-01
 intlbfgs> Highest QCI image energy=    0.5326013722E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5326013722E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    137   -0.1000000000+201    0.2933163997E-02   -0.1000000000+201    0.9767482927E-01    0.6909331413E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6180886625     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.29330E-02 d,cutoff=     2.7853         2.8733     max grad=    0.97679E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813436431        0.5975606824E-01
 intlbfgs> Highest QCI image energy=    0.5326030119E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5326030119E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    138   -0.1000000000+201    0.2933030262E-02   -0.1000000000+201    0.9767933884E-01    0.1515064095E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6180863423     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.29329E-02 d,cutoff=     2.7853         2.8733     max grad=    0.97680E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813436613        0.5955967822E-01
 intlbfgs> Highest QCI image energy=    0.5325960738E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5325960738E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    139   -0.1000000000+201    0.2932939679E-02   -0.1000000000+201    0.9768034635E-01    0.5983807167E-05        15     3
 intlbfgs> Mean deviation     0.5955967822E-01 Decreasing QCI force constant to      2.270506705    
 intlbfgs> largest atomic distance between images is     0.6180862542     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.29329E-02 d,cutoff=     2.7853         2.8733     max grad=    0.97680E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813436613        0.5955123693E-01
 intlbfgs> Highest QCI image energy=    0.5325960594E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5325960594E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    140   -0.1000000000+201    0.2932939149E-02   -0.1000000000+201    0.9768036251E-01    0.1501031563E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6202086320     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.29199E-02 d,cutoff=     2.7855         2.8733     max grad=    0.98147E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8813520344        0.1694481171    
 intlbfgs> Highest QCI image energy=    0.5325734977E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5325734977E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    141   -0.1000000000+201    0.2919863117E-02   -0.1000000000+201    0.9814683027E-01    0.4073138405E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6180861439     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.29329E-02 d,cutoff=     2.7853         2.8733     max grad=    0.97680E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813436614        0.5954069404E-01
 intlbfgs> Highest QCI image energy=    0.5325960714E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5325960714E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    142   -0.1000000000+201    0.2932938859E-02   -0.1000000000+201    0.9768037967E-01    0.4072951489E-02        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6180861441     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.29329E-02 d,cutoff=     2.7853         2.8733     max grad=    0.97680E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813436614        0.5954072623E-01
 intlbfgs> Highest QCI image energy=    0.5325960581E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5325960581E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    143   -0.1000000000+201    0.2932939171E-02   -0.1000000000+201    0.9768036953E-01    0.7213667595E-08        15     3
 intlbfgs> largest atomic distance between images is     0.6180872253     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.29336E-02 d,cutoff=     2.7853         2.8733     max grad=    0.97646E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813438685        0.5968652708E-01
 intlbfgs> Highest QCI image energy=    0.5325122700E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5325122700E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    144   -0.1000000000+201    0.2933608654E-02   -0.1000000000+201    0.9764603634E-01    0.2398591117E-04        15     3
 intlbfgs> Mean deviation     0.5968652708E-01 Decreasing QCI force constant to      2.248026441    
 intlbfgs> largest atomic distance between images is     0.6181014687     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.29195E-02 d,cutoff=     2.7855         2.8733     max grad=    0.97017E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813547324        0.6040028864E-01
 intlbfgs> Highest QCI image energy=    0.5281460894E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5281460894E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    145   -0.1000000000+201    0.2919487219E-02   -0.1000000000+201    0.9701696630E-01    0.2334330928E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6180562767     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.28199E-02 d,cutoff=     2.7870         2.8733     max grad=    0.93756E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814195376        0.5526741477E-01
 intlbfgs> Highest QCI image energy=    0.5031086275E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5031086275E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    146   -0.1000000000+201    0.2819915825E-02   -0.1000000000+201    0.9375605177E-01    0.1438647413E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6180876727     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.29058E-02 d,cutoff=     2.7857         2.8733     max grad=    0.96632E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813627312        0.5919538148E-01
 intlbfgs> Highest QCI image energy=    0.5249647562E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5249647562E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    147   -0.1000000000+201    0.2905805958E-02   -0.1000000000+201    0.9663248886E-01    0.1247539079E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6180854244     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.29056E-02 d,cutoff=     2.7857         2.8733     max grad=    0.96640E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813627048        0.5902928275E-01
 intlbfgs> Highest QCI image energy=    0.5249755318E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5249755318E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    148   -0.1000000000+201    0.2905594957E-02   -0.1000000000+201    0.9663973617E-01    0.8126391001E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6180843805     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.29055E-02 d,cutoff=     2.7857         2.8733     max grad=    0.96641E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813627015        0.5894453785E-01
 intlbfgs> Highest QCI image energy=    0.5249770368E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5249770368E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    149   -0.1000000000+201    0.2905540633E-02   -0.1000000000+201    0.9664143006E-01    0.2625108374E-05        15     3
 intlbfgs> Mean deviation     0.5894453785E-01 Decreasing QCI force constant to      2.225768753    
 intlbfgs> largest atomic distance between images is     0.6180842406     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.29055E-02 d,cutoff=     2.7857         2.8733     max grad=    0.96642E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813627014        0.5893120845E-01
 intlbfgs> Highest QCI image energy=    0.5249771086E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5249771086E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    150   -0.1000000000+201    0.2905538286E-02   -0.1000000000+201    0.9664152654E-01    0.2235986094E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6181143633     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.29001E-02 d,cutoff=     2.7858         2.8733     max grad=    0.96821E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813629454        0.3130787420E-01
 intlbfgs> Highest QCI image energy=    0.5249739389E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5249739389E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    151   -0.1000000000+201    0.2900086391E-02   -0.1000000000+201    0.9682090741E-01    0.4632676227E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6180840546     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.29055E-02 d,cutoff=     2.7857         2.8733     max grad=    0.96642E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813627016        0.5891334622E-01
 intlbfgs> Highest QCI image energy=    0.5249770298E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5249770298E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    152   -0.1000000000+201    0.2905537077E-02   -0.1000000000+201    0.9664157250E-01    0.4629683083E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6180840611     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.29055E-02 d,cutoff=     2.7857         2.8733     max grad=    0.96642E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813627018        0.5891398230E-01
 intlbfgs> Highest QCI image energy=    0.5249769541E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5249769541E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    153   -0.1000000000+201    0.2905534908E-02   -0.1000000000+201    0.9664160287E-01    0.2885171404E-07        15     3
 intlbfgs> largest atomic distance between images is     0.6180922073     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.29024E-02 d,cutoff=     2.7857         2.8733     max grad=    0.96665E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813632118        0.5970303250E-01
 intlbfgs> Highest QCI image energy=    0.5247737551E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5247737551E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    154   -0.1000000000+201    0.2902406263E-02   -0.1000000000+201    0.9666521299E-01    0.3856236497E-04        15     3
 intlbfgs> Mean deviation     0.5970303250E-01 Decreasing QCI force constant to      2.203731439    
 intlbfgs> largest atomic distance between images is     0.6180918741     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.28906E-02 d,cutoff=     2.7859         2.8733     max grad=    0.95904E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813751635        0.5904110502E-01
 intlbfgs> Highest QCI image energy=    0.5200714430E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5200714430E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    155   -0.1000000000+201    0.2890595613E-02   -0.1000000000+201    0.9590436674E-01    0.2514809287E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6180662149     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.28422E-02 d,cutoff=     2.7866         2.8733     max grad=    0.94131E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814089881        0.5634371058E-01
 intlbfgs> Highest QCI image energy=    0.5070709151E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5070709151E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    156   -0.1000000000+201    0.2842192302E-02   -0.1000000000+201    0.9413106681E-01    0.7516984621E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6180849141     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.28785E-02 d,cutoff=     2.7861         2.8733     max grad=    0.95592E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813819973        0.5851212225E-01
 intlbfgs> Highest QCI image energy=    0.5174074442E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5174074442E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    157   -0.1000000000+201    0.2878533600E-02   -0.1000000000+201    0.9559207883E-01    0.5869110098E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6180832825     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.28782E-02 d,cutoff=     2.7861         2.8733     max grad=    0.95603E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813819663        0.5840052596E-01
 intlbfgs> Highest QCI image energy=    0.5174197049E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5174197049E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    158   -0.1000000000+201    0.2878199741E-02   -0.1000000000+201    0.9560260939E-01    0.7715367412E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6180821455     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.28781E-02 d,cutoff=     2.7861         2.8733     max grad=    0.95606E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813819631        0.5830725958E-01
 intlbfgs> Highest QCI image energy=    0.5174211216E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5174211216E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    159   -0.1000000000+201    0.2878078897E-02   -0.1000000000+201    0.9560587511E-01    0.2921653109E-05        15     3
 intlbfgs> Mean deviation     0.5830725958E-01 Decreasing QCI force constant to      2.181912316    
 intlbfgs> largest atomic distance between images is     0.6180818664     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.28781E-02 d,cutoff=     2.7861         2.8733     max grad=    0.95606E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813819628        0.5828096585E-01
 intlbfgs> Highest QCI image energy=    0.5174212978E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5174212978E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    160   -0.1000000000+201    0.2878080953E-02   -0.1000000000+201    0.9560591598E-01    0.4799948551E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6182624897     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.28801E-02 d,cutoff=     2.7861         2.8733     max grad=    0.95626E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813824061        0.2019922578E-01
 intlbfgs> Highest QCI image energy=    0.5174040596E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5174040596E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    161   -0.1000000000+201    0.2880128689E-02   -0.1000000000+201    0.9562612828E-01    0.6947882411E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6180814838     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.28781E-02 d,cutoff=     2.7861         2.8733     max grad=    0.95606E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813819635        0.5824444431E-01
 intlbfgs> Highest QCI image energy=    0.5174210941E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5174210941E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    162   -0.1000000000+201    0.2878084120E-02   -0.1000000000+201    0.9560585932E-01    0.6941245499E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6180814869     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.28781E-02 d,cutoff=     2.7861         2.8733     max grad=    0.95606E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813819640        0.5824484201E-01
 intlbfgs> Highest QCI image energy=    0.5174209045E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5174209045E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    163   -0.1000000000+201    0.2878084052E-02   -0.1000000000+201    0.9560581922E-01    0.2881980004E-07        15     3
 intlbfgs> largest atomic distance between images is     0.6180883407     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.28746E-02 d,cutoff=     2.7862         2.8733     max grad=    0.95417E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813851207        0.5920366196E-01
 intlbfgs> Highest QCI image energy=    0.5161965043E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5161965043E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    164   -0.1000000000+201    0.2874580725E-02   -0.1000000000+201    0.9541666107E-01    0.1086850782E-03        15     3
 intlbfgs> Mean deviation     0.5920366196E-01 Decreasing QCI force constant to      2.160309224    
 intlbfgs> largest atomic distance between images is     0.6180823902     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.28638E-02 d,cutoff=     2.7863         2.8733     max grad=    0.94980E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8813931108        0.5781193141E-01
 intlbfgs> Highest QCI image energy=    0.5131169435E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5131169435E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    165   -0.1000000000+201    0.2863783050E-02   -0.1000000000+201    0.9497997870E-01    0.1889967604E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6184372062     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.25401E-02 d,cutoff=     2.7913         2.8733     max grad=    0.81514E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816585346        0.2635220163E-01
 intlbfgs> Highest QCI image energy=    0.4254107925E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4254107925E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    166   -0.1000000000+201    0.2540094791E-02   -0.1000000000+201    0.8151374497E-01    0.5452875921E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6180780376     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.28533E-02 d,cutoff=     2.7865         2.8733     max grad=    0.94625E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814000896        0.5704951959E-01
 intlbfgs> Highest QCI image energy=    0.5104490586E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5104490586E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    167   -0.1000000000+201    0.2853338552E-02   -0.1000000000+201    0.9462498339E-01    0.5307697004E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6180777677     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.28525E-02 d,cutoff=     2.7865         2.8733     max grad=    0.94618E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814004051        0.5714402095E-01
 intlbfgs> Highest QCI image energy=    0.5103276013E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5103276013E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    168   -0.1000000000+201    0.2852472063E-02   -0.1000000000+201    0.9461801330E-01    0.2479968216E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6180790570     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.28509E-02 d,cutoff=     2.7865         2.8733     max grad=    0.94566E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814014545        0.5758913978E-01
 intlbfgs> Highest QCI image energy=    0.5099257342E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5099257342E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    169   -0.1000000000+201    0.2850864111E-02   -0.1000000000+201    0.9456619163E-01    0.7093198557E-04        15     3
 intlbfgs> Mean deviation     0.5758913978E-01 Decreasing QCI force constant to      2.138920023    
 intlbfgs> largest atomic distance between images is     0.6180787232     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.28504E-02 d,cutoff=     2.7865         2.8733     max grad=    0.94576E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814014459        0.5756545225E-01
 intlbfgs> Highest QCI image energy=    0.5099290475E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5099290475E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    170   -0.1000000000+201    0.2850448488E-02   -0.1000000000+201    0.9457648433E-01    0.5674424755E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6180118282     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.27638E-02 d,cutoff=     2.7878         2.8733     max grad=    0.96468E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814035937        0.5268222574E-01
 intlbfgs> Highest QCI image energy=    0.5096382494E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5096382494E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    171   -0.1000000000+201    0.2763807969E-02   -0.1000000000+201    0.9646839550E-01    0.1144194595E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6180785066     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.28501E-02 d,cutoff=     2.7865         2.8733     max grad=    0.94583E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814014668        0.5754865984E-01
 intlbfgs> Highest QCI image energy=    0.5099211120E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5099211120E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    172   -0.1000000000+201    0.2850109081E-02   -0.1000000000+201    0.9458251519E-01    0.1139940486E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6180785209     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.28501E-02 d,cutoff=     2.7865         2.8733     max grad=    0.94582E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814014825        0.5754965684E-01
 intlbfgs> Highest QCI image energy=    0.5099151473E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5099151473E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    173   -0.1000000000+201    0.2850092792E-02   -0.1000000000+201    0.9458156047E-01    0.3340913525E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6180820802     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.28370E-02 d,cutoff=     2.7867         2.8733     max grad=    0.94058E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814112190        0.5768709744E-01
 intlbfgs> Highest QCI image energy=    0.5062254304E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5062254304E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    174   -0.1000000000+201    0.2837026100E-02   -0.1000000000+201    0.9405778831E-01    0.2080493135E-03        15     3
 intlbfgs> Mean deviation     0.5768709744E-01 Decreasing QCI force constant to      2.117742597    
 intlbfgs> largest atomic distance between images is     0.6180799954     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.28368E-02 d,cutoff=     2.7867         2.8733     max grad=    0.94059E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814112582        0.5747840831E-01
 intlbfgs> Highest QCI image energy=    0.5062109955E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5062109955E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    175   -0.1000000000+201    0.2836840214E-02   -0.1000000000+201    0.9405870456E-01    0.6116156203E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6180691321     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.28260E-02 d,cutoff=     2.7869         2.8733     max grad=    0.94272E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814117789        0.4121327598E-01
 intlbfgs> Highest QCI image energy=    0.5060932509E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5060932509E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    176   -0.1000000000+201    0.2825950374E-02   -0.1000000000+201    0.9427176741E-01    0.4749234036E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6180754034     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.28368E-02 d,cutoff=     2.7867         2.8733     max grad=    0.94062E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814112360        0.5702945131E-01
 intlbfgs> Highest QCI image energy=    0.5062202330E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5062202330E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    177   -0.1000000000+201    0.2836768983E-02   -0.1000000000+201    0.9406232054E-01    0.4629149401E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6180754038     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.28368E-02 d,cutoff=     2.7867         2.8733     max grad=    0.94059E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814112678        0.5703008868E-01
 intlbfgs> Highest QCI image energy=    0.5062082474E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5062082474E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    178   -0.1000000000+201    0.2836800999E-02   -0.1000000000+201    0.9405888050E-01    0.1360087528E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6180723758     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.28356E-02 d,cutoff=     2.7867         2.8733     max grad=    0.93756E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814151892        0.5675291422E-01
 intlbfgs> Highest QCI image energy=    0.5047352301E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5047352301E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    179   -0.1000000000+201    0.2835577082E-02   -0.1000000000+201    0.9375554362E-01    0.1083195375E-03        15     3
 intlbfgs> Mean deviation     0.5675291422E-01 Decreasing QCI force constant to      2.096774849    
 intlbfgs> largest atomic distance between images is     0.6180774726     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.28251E-02 d,cutoff=     2.7869         2.8733     max grad=    0.93528E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814207694        0.5689534733E-01
 intlbfgs> Highest QCI image energy=    0.5026431765E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5026431765E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    180   -0.1000000000+201    0.2825079066E-02   -0.1000000000+201    0.9352833215E-01    0.1344065162E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6180870977     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.28284E-02 d,cutoff=     2.7868         2.8733     max grad=    0.92846E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814279689        0.5783577646E-01
 intlbfgs> Highest QCI image energy=    0.4999812903E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4999812903E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    181   -0.1000000000+201    0.2828441574E-02   -0.1000000000+201    0.9284597688E-01    0.2456589091E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6181237509     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.28010E-02 d,cutoff=     2.7873         2.8733     max grad=    0.92680E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814375717        0.5991399555E-01
 intlbfgs> Highest QCI image energy=    0.4964310583E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4964310583E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    182   -0.1000000000+201    0.2801001741E-02   -0.1000000000+201    0.9268011432E-01    0.4148915137E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6180848200     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.28119E-02 d,cutoff=     2.7871         2.8733     max grad=    0.93078E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814297737        0.5737318264E-01
 intlbfgs> Highest QCI image energy=    0.4992947125E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4992947125E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    183   -0.1000000000+201    0.2811906804E-02   -0.1000000000+201    0.9307808491E-01    0.2359836538E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6180796593     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.28103E-02 d,cutoff=     2.7871         2.8733     max grad=    0.93024E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814308541        0.5698079198E-01
 intlbfgs> Highest QCI image energy=    0.4988955320E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4988955320E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    184   -0.1000000000+201    0.2810339874E-02   -0.1000000000+201    0.9302437268E-01    0.3633461398E-04        15     3
 intlbfgs> Mean deviation     0.5698079198E-01 Decreasing QCI force constant to      2.076014702    
 intlbfgs> largest atomic distance between images is     0.6180752970     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.28093E-02 d,cutoff=     2.7871         2.8733     max grad=    0.93031E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814310832        0.5661424593E-01
 intlbfgs> Highest QCI image energy=    0.4988114612E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4988114612E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    185   -0.1000000000+201    0.2809267293E-02   -0.1000000000+201    0.9303064258E-01    0.1471646285E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6181031414     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.28139E-02 d,cutoff=     2.7871         2.8733     max grad=    0.92915E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814311352        0.5890157320E-01
 intlbfgs> Highest QCI image energy=    0.4987900122E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4987900122E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    186   -0.1000000000+201    0.2813921064E-02   -0.1000000000+201    0.9291527905E-01    0.8221994683E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6180771865     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.28090E-02 d,cutoff=     2.7871         2.8733     max grad=    0.93027E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814312017        0.5674525146E-01
 intlbfgs> Highest QCI image energy=    0.4987674493E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4987674493E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    187   -0.1000000000+201    0.2808992978E-02   -0.1000000000+201    0.9302697101E-01    0.7859790250E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6180755623     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.28084E-02 d,cutoff=     2.7871         2.8733     max grad=    0.93025E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814314066        0.5665219769E-01
 intlbfgs> Highest QCI image energy=    0.4986918858E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4986918858E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    188   -0.1000000000+201    0.2808355874E-02   -0.1000000000+201    0.9302508258E-01    0.1297164854E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6180709448     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.27995E-02 d,cutoff=     2.7873         2.8733     max grad=    0.92922E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814351270        0.5652068622E-01
 intlbfgs> Highest QCI image energy=    0.4973217196E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4973217196E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    189   -0.1000000000+201    0.2799534786E-02   -0.1000000000+201    0.9292206125E-01    0.1210663232E-03        15     3
 intlbfgs> Mean deviation     0.5652068622E-01 Decreasing QCI force constant to      2.055460101    
 intlbfgs> largest atomic distance between images is     0.6180760046     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.27952E-02 d,cutoff=     2.7873         2.8733     max grad=    0.92419E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814423129        0.5620462930E-01
 intlbfgs> Highest QCI image energy=    0.4946849609E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4946849609E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    190   -0.1000000000+201    0.2795226299E-02   -0.1000000000+201    0.9241903148E-01    0.1650895561E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6210558814     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.16787E-02 d,cutoff=     2.8064         2.8733     max grad=    0.50172E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8841888737        0.3093752999E-01
 intlbfgs> Highest QCI image energy=    0.2257369641E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2257369641E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    191   -0.1000000000+201    0.1678656952E-02   -0.1000000000+201    0.5017226291E-01    0.4041009949E-01        15     3
 intlbfgs> largest atomic distance between images is     0.6180802618     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.27901E-02 d,cutoff=     2.7874         2.8733     max grad=    0.91892E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814500715        0.5593834026E-01
 intlbfgs> Highest QCI image energy=    0.4918656674E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4918656674E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    192   -0.1000000000+201    0.2790073441E-02   -0.1000000000+201    0.9189232206E-01    0.4024509023E-01        15     3
 intlbfgs> largest atomic distance between images is     0.6180764754     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.27903E-02 d,cutoff=     2.7874         2.8733     max grad=    0.92055E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814480502        0.5583167413E-01
 intlbfgs> Highest QCI image energy=    0.4925967672E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4925967672E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    193   -0.1000000000+201    0.2790343427E-02   -0.1000000000+201    0.9205464373E-01    0.5100550846E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6180746734     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.27893E-02 d,cutoff=     2.7874         2.8733     max grad=    0.92062E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814482550        0.5572918191E-01
 intlbfgs> Highest QCI image energy=    0.4925217876E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4925217876E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    194   -0.1000000000+201    0.2789307387E-02   -0.1000000000+201    0.9206229265E-01    0.1569047895E-04        15     3
 intlbfgs> Mean deviation     0.5572918191E-01 Decreasing QCI force constant to      2.035109011    
 intlbfgs> largest atomic distance between images is     0.6180680862     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.27817E-02 d,cutoff=     2.7875         2.8733     max grad=    0.92009E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814510733        0.5553371902E-01
 intlbfgs> Highest QCI image energy=    0.4914973750E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4914973750E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    195   -0.1000000000+201    0.2781739840E-02   -0.1000000000+201    0.9200941498E-01    0.1177267181E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6180584611     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.27037E-02 d,cutoff=     2.7887         2.8733     max grad=    0.92399E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814702177        0.5286639184E-01
 intlbfgs> Highest QCI image energy=    0.4850079582E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4850079582E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    196   -0.1000000000+201    0.2703682636E-02   -0.1000000000+201    0.9239884810E-01    0.1315682601E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6180630670     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.27781E-02 d,cutoff=     2.7876         2.8733     max grad=    0.92079E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814513338        0.5563869442E-01
 intlbfgs> Highest QCI image energy=    0.4914056725E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4914056725E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    197   -0.1000000000+201    0.2778085716E-02   -0.1000000000+201    0.9207898173E-01    0.1218978320E-02        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6180651184     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.27783E-02 d,cutoff=     2.7876         2.8733     max grad=    0.92028E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814518717        0.5576756778E-01
 intlbfgs> Highest QCI image energy=    0.4912100823E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4912100823E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    198   -0.1000000000+201    0.2778306745E-02   -0.1000000000+201    0.9202845871E-01    0.1590743171E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6180793310     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.27726E-02 d,cutoff=     2.7877         2.8733     max grad=    0.91524E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814595015        0.5649316880E-01
 intlbfgs> Highest QCI image energy=    0.4884550240E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4884550240E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    199   -0.1000000000+201    0.2772645386E-02   -0.1000000000+201    0.9152384293E-01    0.1610519215E-03        15     3
 intlbfgs> Mean deviation     0.5649316880E-01 Decreasing QCI force constant to      2.014959417    
 intlbfgs> largest atomic distance between images is     0.6180742786     for atom     10 and images      2     3 total images=     1
 checkrep> number of active repulsions and total=      56      56
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.27681E-02 d,cutoff=     2.7878         2.8733     max grad=    0.91494E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814611584        0.5594378492E-01
 intlbfgs> Highest QCI image energy=    0.4878602550E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4878602550E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    200   -0.1000000000+201    0.2768138025E-02   -0.1000000000+201    0.9149366306E-01    0.5257056465E-04        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6180846128     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.27698E-02 d,cutoff=     2.7877         2.8733     max grad=    0.91322E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814627251        0.5683213456E-01
 intlbfgs> Highest QCI image energy=    0.4872985830E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4872985830E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    201   -0.1000000000+201    0.2769825444E-02   -0.1000000000+201    0.9132233484E-01    0.6112130349E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6180851234     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.27551E-02 d,cutoff=     2.7880         2.8733     max grad=    0.90996E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814708673        0.5641479494E-01
 intlbfgs> Highest QCI image energy=    0.4843936811E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4843936811E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    202   -0.1000000000+201    0.2755083495E-02   -0.1000000000+201    0.9099648408E-01    0.1862623576E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6180756525     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.27547E-02 d,cutoff=     2.7880         2.8733     max grad=    0.90990E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814711055        0.5571033409E-01
 intlbfgs> Highest QCI image energy=    0.4843092014E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4843092014E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    203   -0.1000000000+201    0.2754710093E-02   -0.1000000000+201    0.9098953402E-01    0.4157063320E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6180667011     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.27539E-02 d,cutoff=     2.7880         2.8733     max grad=    0.90991E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814713599        0.5498865724E-01
 intlbfgs> Highest QCI image energy=    0.4842198484E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4842198484E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    204   -0.1000000000+201    0.2753920384E-02   -0.1000000000+201    0.9099059407E-01    0.2923855123E-04        15     3
 intlbfgs> Mean deviation     0.5498865724E-01 Decreasing QCI force constant to      1.995009323    
 intlbfgs> largest atomic distance between images is     0.6180660764     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.27539E-02 d,cutoff=     2.7880         2.8733     max grad=    0.90990E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814713653        0.5492790767E-01
 intlbfgs> Highest QCI image energy=    0.4842180186E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4842180186E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    205   -0.1000000000+201    0.2753925909E-02   -0.1000000000+201    0.9099016068E-01    0.1109014484E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6180365550     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.27549E-02 d,cutoff=     2.7880         2.8733     max grad=    0.90975E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814713889        0.5122079395E-01
 intlbfgs> Highest QCI image energy=    0.4842167568E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4842167568E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    206   -0.1000000000+201    0.2754852371E-02   -0.1000000000+201    0.9097534229E-01    0.6867964266E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6180642675     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.27536E-02 d,cutoff=     2.7880         2.8733     max grad=    0.90997E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814713671        0.5476066538E-01
 intlbfgs> Highest QCI image energy=    0.4842176802E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4842176802E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    207   -0.1000000000+201    0.2753648459E-02   -0.1000000000+201    0.9099693067E-01    0.6736857423E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6180660518     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.27540E-02 d,cutoff=     2.7880         2.8733     max grad=    0.90988E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814713638        0.5492743979E-01
 intlbfgs> Highest QCI image energy=    0.4842185601E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4842185601E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    208   -0.1000000000+201    0.2754032135E-02   -0.1000000000+201    0.9098779147E-01    0.5731190517E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6180647567     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.27538E-02 d,cutoff=     2.7880         2.8733     max grad=    0.90994E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814713633        0.5480680311E-01
 intlbfgs> Highest QCI image energy=    0.4842189483E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4842189483E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    209   -0.1000000000+201    0.2753790129E-02   -0.1000000000+201    0.9099381972E-01    0.3746477014E-05        15     3
 intlbfgs> Mean deviation     0.5480680311E-01 Decreasing QCI force constant to      1.975256756    
 intlbfgs> largest atomic distance between images is     0.6180754932     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.27391E-02 d,cutoff=     2.7882         2.8733     max grad=    0.90386E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814829972        0.5526089115E-01
 intlbfgs> Highest QCI image energy=    0.4801098222E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4801098222E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    210   -0.1000000000+201    0.2739070029E-02   -0.1000000000+201    0.9038618592E-01    0.2347062474E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6181741584     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.26311E-02 d,cutoff=     2.7899         2.8733     max grad=    0.86566E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815633476        0.4978703911E-01
 intlbfgs> Highest QCI image energy=    0.4529584069E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4529584069E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    211   -0.1000000000+201    0.2631085829E-02   -0.1000000000+201    0.8656589460E-01    0.1697831971E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6180631066     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.27263E-02 d,cutoff=     2.7884         2.8733     max grad=    0.89970E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814918652        0.5421167414E-01
 intlbfgs> Highest QCI image energy=    0.4770093098E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4770093098E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    212   -0.1000000000+201    0.2726331216E-02   -0.1000000000+201    0.8996999489E-01    0.1496682134E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6180617159     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.27263E-02 d,cutoff=     2.7884         2.8733     max grad=    0.89974E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814918383        0.5410989934E-01
 intlbfgs> Highest QCI image energy=    0.4770188128E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4770188128E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    213   -0.1000000000+201    0.2726256284E-02   -0.1000000000+201    0.8997432080E-01    0.5450262796E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6180612531     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.27262E-02 d,cutoff=     2.7884         2.8733     max grad=    0.89975E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814918347        0.5407285898E-01
 intlbfgs> Highest QCI image energy=    0.4770201376E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4770201376E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    214   -0.1000000000+201    0.2726231376E-02   -0.1000000000+201    0.8997526183E-01    0.1802721545E-05        15     3
 intlbfgs> Mean deviation     0.5407285898E-01 Decreasing QCI force constant to      1.955699758    
 intlbfgs> largest atomic distance between images is     0.6180612009     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.27262E-02 d,cutoff=     2.7884         2.8733     max grad=    0.89975E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814918350        0.5406749880E-01
 intlbfgs> Highest QCI image energy=    0.4770200298E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4770200298E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    215   -0.1000000000+201    0.2726229493E-02   -0.1000000000+201    0.8997526601E-01    0.2116698889E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6180699628     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.27252E-02 d,cutoff=     2.7884         2.8733     max grad=    0.89989E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814918708        0.5015976232E-01
 intlbfgs> Highest QCI image energy=    0.4770195228E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4770195228E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    216   -0.1000000000+201    0.2725151851E-02   -0.1000000000+201    0.8998926750E-01    0.1550965240E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6180611262     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.27262E-02 d,cutoff=     2.7884         2.8733     max grad=    0.89975E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814918348        0.5406008709E-01
 intlbfgs> Highest QCI image energy=    0.4770201220E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4770201220E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    217   -0.1000000000+201    0.2726223064E-02   -0.1000000000+201    0.8997542184E-01    0.1548831593E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6180611454     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.27262E-02 d,cutoff=     2.7884         2.8733     max grad=    0.89975E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814918351        0.5406180219E-01
 intlbfgs> Highest QCI image energy=    0.4770200277E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4770200277E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    218   -0.1000000000+201    0.2726220657E-02   -0.1000000000+201    0.8997545666E-01    0.5517557557E-07        15     3
 intlbfgs> largest atomic distance between images is     0.6180740188     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.27251E-02 d,cutoff=     2.7884         2.8733     max grad=    0.89980E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8814920976        0.5521801159E-01
 intlbfgs> Highest QCI image energy=    0.4769268906E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4769268906E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    219   -0.1000000000+201    0.2725098400E-02   -0.1000000000+201    0.8997981550E-01    0.2850518478E-04        15     3
 intlbfgs> Mean deviation     0.5521801159E-01 Decreasing QCI force constant to      1.936336394    
 intlbfgs> largest atomic distance between images is     0.6180715708     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.27138E-02 d,cutoff=     2.7886         2.8733     max grad=    0.89193E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815051183        0.5444671449E-01
 intlbfgs> Highest QCI image energy=    0.4724253099E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4724253099E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    220   -0.1000000000+201    0.2713771747E-02   -0.1000000000+201    0.8919321806E-01    0.2610068672E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6181278336     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.26643E-02 d,cutoff=     2.7893         2.8733     max grad=    0.87651E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815392400        0.5074409520E-01
 intlbfgs> Highest QCI image energy=    0.4608867717E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4608867717E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    221   -0.1000000000+201    0.2664267775E-02   -0.1000000000+201    0.8765083610E-01    0.7242776755E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6180661777     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.26994E-02 d,cutoff=     2.7888         2.8733     max grad=    0.88938E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815125826        0.5332149398E-01
 intlbfgs> Highest QCI image energy=    0.4698679641E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4698679641E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    222   -0.1000000000+201    0.2699368221E-02   -0.1000000000+201    0.8893798800E-01    0.5480574407E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6180678543     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.26987E-02 d,cutoff=     2.7888         2.8733     max grad=    0.88959E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815125233        0.5319083324E-01
 intlbfgs> Highest QCI image energy=    0.4698883361E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4698883361E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    223   -0.1000000000+201    0.2698708334E-02   -0.1000000000+201    0.8895926553E-01    0.1139327992E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6180682229     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.26985E-02 d,cutoff=     2.7888         2.8733     max grad=    0.88965E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815125225        0.5316843123E-01
 intlbfgs> Highest QCI image energy=    0.4698886483E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4698886483E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    224   -0.1000000000+201    0.2698500049E-02   -0.1000000000+201    0.8896465441E-01    0.3724106816E-05        15     3
 intlbfgs> Mean deviation     0.5316843123E-01 Decreasing QCI force constant to      1.917164747    
 intlbfgs> largest atomic distance between images is     0.6180681051     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.26985E-02 d,cutoff=     2.7888         2.8733     max grad=    0.88965E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815125228        0.5317986382E-01
 intlbfgs> Highest QCI image energy=    0.4698885336E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4698885336E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    225   -0.1000000000+201    0.2698501712E-02   -0.1000000000+201    0.8896462240E-01    0.2040563634E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6181419660     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.27001E-02 d,cutoff=     2.7888         2.8733     max grad=    0.88953E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815124960        0.6171708586E-01
 intlbfgs> Highest QCI image energy=    0.4698876167E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4698876167E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    226   -0.1000000000+201    0.2700064758E-02   -0.1000000000+201    0.8895285049E-01    0.1518557810E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6180679127     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.26985E-02 d,cutoff=     2.7888         2.8733     max grad=    0.88965E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815125224        0.5319839368E-01
 intlbfgs> Highest QCI image energy=    0.4698886320E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4698886320E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    227   -0.1000000000+201    0.2698507084E-02   -0.1000000000+201    0.8896455199E-01    0.1515479412E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6180679350     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.26985E-02 d,cutoff=     2.7888         2.8733     max grad=    0.88964E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815125227        0.5319641411E-01
 intlbfgs> Highest QCI image energy=    0.4698885321E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4698885321E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    228   -0.1000000000+201    0.2698508503E-02   -0.1000000000+201    0.8896449074E-01    0.6121282148E-07        15     3
 intlbfgs> largest atomic distance between images is     0.6180789442     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.26987E-02 d,cutoff=     2.7888         2.8733     max grad=    0.88937E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815127852        0.5223740497E-01
 intlbfgs> Highest QCI image energy=    0.4698006753E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4698006753E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    229   -0.1000000000+201    0.2698723277E-02   -0.1000000000+201    0.8893735170E-01    0.2754110642E-04        15     3
 intlbfgs> Mean deviation     0.5223740497E-01 Decreasing QCI force constant to      1.898182918    
 intlbfgs> largest atomic distance between images is     0.6180731910     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.26841E-02 d,cutoff=     2.7890         2.8733     max grad=    0.88188E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815264796        0.5410602726E-01
 intlbfgs> Highest QCI image energy=    0.4651558629E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4651558629E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    230   -0.1000000000+201    0.2684103124E-02   -0.1000000000+201    0.8818840227E-01    0.2698135132E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6181480201     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.26377E-02 d,cutoff=     2.7898         2.8733     max grad=    0.86943E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815563258        0.5097122168E-01
 intlbfgs> Highest QCI image energy=    0.4552455082E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4552455082E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    231   -0.1000000000+201    0.2637731715E-02   -0.1000000000+201    0.8694284827E-01    0.6488408221E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6181049154     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.26709E-02 d,cutoff=     2.7892         2.8733     max grad=    0.87949E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815334677        0.5220740875E-01
 intlbfgs> Highest QCI image energy=    0.4628107304E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4628107304E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    232   -0.1000000000+201    0.2670945153E-02   -0.1000000000+201    0.8794946306E-01    0.4766019595E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6181054336     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.26708E-02 d,cutoff=     2.7892         2.8733     max grad=    0.87957E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815334298        0.5217610694E-01
 intlbfgs> Highest QCI image energy=    0.4628234437E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4628234437E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    233   -0.1000000000+201    0.2670767848E-02   -0.1000000000+201    0.8795743750E-01    0.5645478643E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6181049233     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.26708E-02 d,cutoff=     2.7892         2.8733     max grad=    0.87958E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815334280        0.5223025317E-01
 intlbfgs> Highest QCI image energy=    0.4628239426E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4628239426E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    234   -0.1000000000+201    0.2670751919E-02   -0.1000000000+201    0.8795828463E-01    0.1922513316E-05        15     3
 intlbfgs> Mean deviation     0.5223025317E-01 Decreasing QCI force constant to      1.879389027    
 intlbfgs> largest atomic distance between images is     0.6181045401     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.26707E-02 d,cutoff=     2.7892         2.8733     max grad=    0.87958E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815334278        0.5226648229E-01
 intlbfgs> Highest QCI image energy=    0.4628239604E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4628239604E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    235   -0.1000000000+201    0.2670745086E-02   -0.1000000000+201    0.8795849131E-01    0.5810415737E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6385002359     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.23016E-02 d,cutoff=     2.7952         2.8733     max grad=    0.97762E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8819166017         2.006726302    
 intlbfgs> Highest QCI image energy=    0.4732463016E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4732463016E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    236   -0.1000000000+201    0.2301643574E-02   -0.1000000000+201    0.9776248138E-01    0.3138145535E-01        15     3
 intlbfgs> largest atomic distance between images is     0.6181040177     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.26707E-02 d,cutoff=     2.7892         2.8733     max grad=    0.87958E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815334277        0.5231565861E-01
 intlbfgs> Highest QCI image energy=    0.4628239130E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4628239130E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    237   -0.1000000000+201    0.2670745535E-02   -0.1000000000+201    0.8795848059E-01    0.3138075248E-01        15     3
 intlbfgs> largest atomic distance between images is     0.6181040497     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.26707E-02 d,cutoff=     2.7892         2.8733     max grad=    0.87959E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815334278        0.5231265731E-01
 intlbfgs> Highest QCI image energy=    0.4628238815E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4628238815E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    238   -0.1000000000+201    0.2670740410E-02   -0.1000000000+201    0.8795859690E-01    0.8081569444E-07        15     3
 intlbfgs> largest atomic distance between images is     0.6181063872     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.26704E-02 d,cutoff=     2.7892         2.8733     max grad=    0.87966E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815334422        0.5209454842E-01
 intlbfgs> Highest QCI image energy=    0.4628194273E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4628194273E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    239   -0.1000000000+201    0.2670387114E-02   -0.1000000000+201    0.8796619137E-01    0.5626554475E-05        15     3
 intlbfgs> Mean deviation     0.5209454842E-01 Decreasing QCI force constant to      1.860781215    
 intlbfgs> largest atomic distance between images is     0.6181202978     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.26569E-02 d,cutoff=     2.7895         2.8733     max grad=    0.87323E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815455758        0.5197649748E-01
 intlbfgs> Highest QCI image energy=    0.4587834764E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4587834764E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    240   -0.1000000000+201    0.2656907145E-02   -0.1000000000+201    0.8732344518E-01    0.2358127520E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6182502701     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.25649E-02 d,cutoff=     2.7909         2.8733     max grad=    0.84135E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816155010        0.4854573619E-01
 intlbfgs> Highest QCI image energy=    0.4363888197E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4363888197E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    241   -0.1000000000+201    0.2564918480E-02   -0.1000000000+201    0.8413492185E-01    0.1434554801E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6181414772     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.26434E-02 d,cutoff=     2.7897         2.8733     max grad=    0.86941E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815545930        0.5128535814E-01
 intlbfgs> Highest QCI image energy=    0.4558124971E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4558124971E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    242   -0.1000000000+201    0.2643428863E-02   -0.1000000000+201    0.8694139589E-01    0.1232210236E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6181419445     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.26431E-02 d,cutoff=     2.7897         2.8733     max grad=    0.86953E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815545554        0.5127566730E-01
 intlbfgs> Highest QCI image energy=    0.4558248098E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4558248098E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    243   -0.1000000000+201    0.2643118233E-02   -0.1000000000+201    0.8695259669E-01    0.1046452899E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6181417563     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.26430E-02 d,cutoff=     2.7897         2.8733     max grad=    0.86957E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815545499        0.5130563821E-01
 intlbfgs> Highest QCI image energy=    0.4558265465E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4558265465E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    244   -0.1000000000+201    0.2642974332E-02   -0.1000000000+201    0.8695669566E-01    0.4014192466E-05        15     3
 intlbfgs> Mean deviation     0.5130563821E-01 Decreasing QCI force constant to      1.842357639    
 intlbfgs> largest atomic distance between images is     0.6181415865     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.26430E-02 d,cutoff=     2.7897         2.8733     max grad=    0.86957E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815545499        0.5132130179E-01
 intlbfgs> Highest QCI image energy=    0.4558265412E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4558265412E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    245   -0.1000000000+201    0.2642976914E-02   -0.1000000000+201    0.8695660517E-01    0.2707450206E-06        15     3
 intlbfgs> largest atomic distance between images is     0.7440047642     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     49 atoms      6    10 value=    0.98217E-02 d,cutoff=     2.6536         2.8083     max grad=    0.17367    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8983556771         11.19143161    
 intlbfgs> Highest QCI image energy=    0.1611762903E-01 images=       1
 intlbfgs> Highest image        2 energy     0.1611762903E-01 is      0.000000000     sigma from the mean
 intlbfgs> steps:    246   -0.1000000000+201    0.9821748508E-02   -0.1000000000+201    0.1736719802        0.8129899943            15     3
 intlbfgs> largest atomic distance between images is     0.6181413207     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.26430E-02 d,cutoff=     2.7897         2.8733     max grad=    0.86957E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815545498        0.5134576017E-01
 intlbfgs> Highest QCI image energy=    0.4558265393E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4558265393E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    247   -0.1000000000+201    0.2642978243E-02   -0.1000000000+201    0.8695652237E-01    0.1999996304            15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6181413199     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.26430E-02 d,cutoff=     2.7897         2.8733     max grad=    0.86957E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815545498        0.5134577849E-01
 intlbfgs> Highest QCI image energy=    0.4558265372E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4558265372E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    248   -0.1000000000+201    0.2642977329E-02   -0.1000000000+201    0.8695653483E-01    0.3206798577E-07        15     3
 intlbfgs> largest atomic distance between images is     0.6181413231     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.26430E-02 d,cutoff=     2.7897         2.8733     max grad=    0.86957E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815545503        0.5134357445E-01
 intlbfgs> Highest QCI image energy=    0.4558263576E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4558263576E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    249   -0.1000000000+201    0.2642951904E-02   -0.1000000000+201    0.8695673301E-01    0.1524079054E-05        15     3
 intlbfgs> Mean deviation     0.5134357445E-01 Decreasing QCI force constant to      1.824116474    
 intlbfgs> largest atomic distance between images is     0.6181641187     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.26232E-02 d,cutoff=     2.7900         2.8733     max grad=    0.85848E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815747312        0.5119440832E-01
 intlbfgs> Highest QCI image energy=    0.4492722315E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4492722315E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    250   -0.1000000000+201    0.2623163716E-02   -0.1000000000+201    0.8584810287E-01    0.3868712144E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6181784840     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.26141E-02 d,cutoff=     2.7901         2.8733     max grad=    0.85911E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815768487        0.5047045417E-01
 intlbfgs> Highest QCI image energy=    0.4485877187E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4485877187E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    251   -0.1000000000+201    0.2614105954E-02   -0.1000000000+201    0.8591058832E-01    0.1350487672E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6181777778     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.26160E-02 d,cutoff=     2.7901         2.8733     max grad=    0.86012E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815749614        0.5040462895E-01
 intlbfgs> Highest QCI image energy=    0.4491947363E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4491947363E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    252   -0.1000000000+201    0.2615994817E-02   -0.1000000000+201    0.8601200728E-01    0.4037947198E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6181786184     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.26152E-02 d,cutoff=     2.7901         2.8733     max grad=    0.85960E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815758810        0.5040061057E-01
 intlbfgs> Highest QCI image energy=    0.4488988497E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4488988497E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    253   -0.1000000000+201    0.2615169148E-02   -0.1000000000+201    0.8596026665E-01    0.1825676659E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6181788472     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.26152E-02 d,cutoff=     2.7901         2.8733     max grad=    0.85960E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815758875        0.5038077201E-01
 intlbfgs> Highest QCI image energy=    0.4488967804E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4488967804E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    254   -0.1000000000+201    0.2615182811E-02   -0.1000000000+201    0.8595952971E-01    0.5395113516E-06        15     3
 intlbfgs> Mean deviation     0.5038077201E-01 Decreasing QCI force constant to      1.806055915    
 intlbfgs> largest atomic distance between images is     0.6181791334     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.26152E-02 d,cutoff=     2.7901         2.8733     max grad=    0.85959E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815758887        0.5035458224E-01
 intlbfgs> Highest QCI image energy=    0.4488964341E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4488964341E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    255   -0.1000000000+201    0.2615187891E-02   -0.1000000000+201    0.8595942878E-01    0.4497709752E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6182412373     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.26165E-02 d,cutoff=     2.7901         2.8733     max grad=    0.85951E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815759222        0.4465179521E-01
 intlbfgs> Highest QCI image energy=    0.4488951663E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4488951663E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    256   -0.1000000000+201    0.2616488579E-02   -0.1000000000+201    0.8595067860E-01    0.9784091382E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6181793658     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.26152E-02 d,cutoff=     2.7901         2.8733     max grad=    0.85959E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815758880        0.5033101809E-01
 intlbfgs> Highest QCI image energy=    0.4488966888E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4488966888E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    257   -0.1000000000+201    0.2615223893E-02   -0.1000000000+201    0.8595870758E-01    0.9740794443E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6181792765     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.26152E-02 d,cutoff=     2.7901         2.8733     max grad=    0.85958E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815758886        0.5033738522E-01
 intlbfgs> Highest QCI image energy=    0.4488964814E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4488964814E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    258   -0.1000000000+201    0.2615240012E-02   -0.1000000000+201    0.8595820111E-01    0.5227374003E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6181783716     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.26154E-02 d,cutoff=     2.7901         2.8733     max grad=    0.85952E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815759032        0.5039889205E-01
 intlbfgs> Highest QCI image energy=    0.4488917183E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4488917183E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    259   -0.1000000000+201    0.2615399082E-02   -0.1000000000+201    0.8595236735E-01    0.6245633138E-05        15     3
 intlbfgs> Mean deviation     0.5039889205E-01 Decreasing QCI force constant to      1.788174173    
 intlbfgs> largest atomic distance between images is     0.6182096340     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.25983E-02 d,cutoff=     2.7904         2.8733     max grad=    0.85259E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815902708        0.4926018379E-01
 intlbfgs> Highest QCI image energy=    0.4443032825E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4443032825E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    260   -0.1000000000+201    0.2598290920E-02   -0.1000000000+201    0.8525856065E-01    0.2905609455E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6182968383     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.25487E-02 d,cutoff=     2.7911         2.8733     max grad=    0.84126E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816209544        0.4466717688E-01
 intlbfgs> Highest QCI image energy=    0.4347135859E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4347135859E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    261   -0.1000000000+201    0.2548736029E-02   -0.1000000000+201    0.8412564016E-01    0.6492884208E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6182231775     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.25876E-02 d,cutoff=     2.7905         2.8733     max grad=    0.84963E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815974651        0.4881511189E-01
 intlbfgs> Highest QCI image energy=    0.4420278898E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4420278898E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    262   -0.1000000000+201    0.2587564654E-02   -0.1000000000+201    0.8496307940E-01    0.5031839959E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6182206788     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.25874E-02 d,cutoff=     2.7905         2.8733     max grad=    0.84968E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815974308        0.4904038030E-01
 intlbfgs> Highest QCI image energy=    0.4420383823E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4420383823E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    263   -0.1000000000+201    0.2587405189E-02   -0.1000000000+201    0.8496849657E-01    0.4469147780E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6182177460     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.25874E-02 d,cutoff=     2.7905         2.8733     max grad=    0.84967E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815974406        0.4931260772E-01
 intlbfgs> Highest QCI image energy=    0.4420349056E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4420349056E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    264   -0.1000000000+201    0.2587378940E-02   -0.1000000000+201    0.8496732170E-01    0.4019381344E-05        15     3
 intlbfgs> Mean deviation     0.4931260772E-01 Decreasing QCI force constant to      1.770469478    
 intlbfgs> largest atomic distance between images is     0.6182175662     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.25874E-02 d,cutoff=     2.7905         2.8733     max grad=    0.84967E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815974409        0.4933010057E-01
 intlbfgs> Highest QCI image energy=    0.4420347987E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4420347987E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    265   -0.1000000000+201    0.2587384715E-02   -0.1000000000+201    0.8496734011E-01    0.4864568745E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6185480349     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.26059E-02 d,cutoff=     2.7902         2.8733     max grad=    0.85060E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815983753        0.1013442194    
 intlbfgs> Highest QCI image energy=    0.4420748457E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4420748457E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    266   -0.1000000000+201    0.2605880207E-02   -0.1000000000+201    0.8506026562E-01    0.1445229552E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6182174031     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.25874E-02 d,cutoff=     2.7905         2.8733     max grad=    0.84967E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815974406        0.4934600845E-01
 intlbfgs> Highest QCI image energy=    0.4420348863E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4420348863E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    267   -0.1000000000+201    0.2587390341E-02   -0.1000000000+201    0.8496737800E-01    0.1444818577E-02        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6182174059     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.25874E-02 d,cutoff=     2.7905         2.8733     max grad=    0.84967E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815974409        0.4934583074E-01
 intlbfgs> Highest QCI image energy=    0.4420347902E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4420347902E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    268   -0.1000000000+201    0.2587390861E-02   -0.1000000000+201    0.8496734290E-01    0.2335796196E-07        15     3
 intlbfgs> largest atomic distance between images is     0.6182289968     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.25871E-02 d,cutoff=     2.7905         2.8733     max grad=    0.84861E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8815989757        0.4858201498E-01
 intlbfgs> Highest QCI image energy=    0.4415532777E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4415532777E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    269   -0.1000000000+201    0.2587103680E-02   -0.1000000000+201    0.8486055951E-01    0.6665400499E-04        15     3
 intlbfgs> Mean deviation     0.4858201498E-01 Decreasing QCI force constant to      1.752940078    
 intlbfgs> largest atomic distance between images is     0.6182324997     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.25735E-02 d,cutoff=     2.7908         2.8733     max grad=    0.84313E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816103140        0.4923163192E-01
 intlbfgs> Highest QCI image energy=    0.4380010926E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4380010926E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    270   -0.1000000000+201    0.2573470936E-02   -0.1000000000+201    0.8431344156E-01    0.2230622948E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6183487130     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.24705E-02 d,cutoff=     2.7924         2.8733     max grad=    0.80693E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816920713        0.4724497646E-01
 intlbfgs> Highest QCI image energy=    0.4134683377E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4134683377E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    271   -0.1000000000+201    0.2470452267E-02   -0.1000000000+201    0.8069291584E-01    0.1565097535E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6182529270     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.25608E-02 d,cutoff=     2.7910         2.8733     max grad=    0.83960E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816190344        0.4845720239E-01
 intlbfgs> Highest QCI image energy=    0.4352948822E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4352948822E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    272   -0.1000000000+201    0.2560815069E-02   -0.1000000000+201    0.8395976265E-01    0.1387575238E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6182560607     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.25601E-02 d,cutoff=     2.7910         2.8733     max grad=    0.83974E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816191128        0.4825276928E-01
 intlbfgs> Highest QCI image energy=    0.4352706309E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4352706309E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    273   -0.1000000000+201    0.2560085053E-02   -0.1000000000+201    0.8397373891E-01    0.2198608440E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6182571563     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.25596E-02 d,cutoff=     2.7910         2.8733     max grad=    0.83979E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816192110        0.4822066478E-01
 intlbfgs> Highest QCI image energy=    0.4352402714E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4352402714E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    274   -0.1000000000+201    0.2559609268E-02   -0.1000000000+201    0.8397910498E-01    0.1608285633E-04        15     3
 intlbfgs> Mean deviation     0.4822066478E-01 Decreasing QCI force constant to      1.735584235    
 intlbfgs> largest atomic distance between images is     0.6182568199     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.25596E-02 d,cutoff=     2.7910         2.8733     max grad=    0.83980E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816192091        0.4825316136E-01
 intlbfgs> Highest QCI image energy=    0.4352408006E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4352408006E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    275   -0.1000000000+201    0.2559559664E-02   -0.1000000000+201    0.8398040697E-01    0.9364629280E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6181721024     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.25366E-02 d,cutoff=     2.7913         2.8733     max grad=    0.84520E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816193146        0.6259705517E-01
 intlbfgs> Highest QCI image energy=    0.4352377502E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4352377502E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    276   -0.1000000000+201    0.2536567266E-02   -0.1000000000+201    0.8451971117E-01    0.4163463904E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6182563845     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.25595E-02 d,cutoff=     2.7910         2.8733     max grad=    0.83981E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816192111        0.4829564855E-01
 intlbfgs> Highest QCI image energy=    0.4352401517E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4352401517E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    277   -0.1000000000+201    0.2559516281E-02   -0.1000000000+201    0.8398125168E-01    0.4154492353E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6182563608     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.25595E-02 d,cutoff=     2.7910         2.8733     max grad=    0.83981E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816192130        0.4829821406E-01
 intlbfgs> Highest QCI image energy=    0.4352395508E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4352395508E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    278   -0.1000000000+201    0.2559516324E-02   -0.1000000000+201    0.8398110135E-01    0.6139739499E-07        15     3
 intlbfgs> largest atomic distance between images is     0.6182034399     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.25549E-02 d,cutoff=     2.7910         2.8733     max grad=    0.83600E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816256487        0.5430105079E-01
 intlbfgs> Highest QCI image energy=    0.4332501092E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4332501092E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    279   -0.1000000000+201    0.2554879929E-02   -0.1000000000+201    0.8360047257E-01    0.1587765109E-03        15     3
 intlbfgs> Mean deviation     0.5430105079E-01 Decreasing QCI force constant to      1.718400233    
 intlbfgs> largest atomic distance between images is     0.6182443082     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.25474E-02 d,cutoff=     2.7912         2.8733     max grad=    0.83494E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816294598        0.5066791873E-01
 intlbfgs> Highest QCI image energy=    0.4320843697E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4320843697E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    280   -0.1000000000+201    0.2547405925E-02   -0.1000000000+201    0.8349393410E-01    0.1042798649E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6184089392     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.25337E-02 d,cutoff=     2.7914         2.8733     max grad=    0.83842E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816294213        0.3428966631E-01
 intlbfgs> Highest QCI image energy=    0.4321396586E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4321396586E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    281   -0.1000000000+201    0.2533716696E-02   -0.1000000000+201    0.8384220773E-01    0.3234246814E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6182536171     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.25476E-02 d,cutoff=     2.7912         2.8733     max grad=    0.83396E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816306191        0.4967941193E-01
 intlbfgs> Highest QCI image energy=    0.4317321676E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4317321676E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    282   -0.1000000000+201    0.2547624124E-02   -0.1000000000+201    0.8339630886E-01    0.3085891474E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6182490068     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.25472E-02 d,cutoff=     2.7912         2.8733     max grad=    0.83386E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816308958        0.5021596734E-01
 intlbfgs> Highest QCI image energy=    0.4316465300E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4316465300E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    283   -0.1000000000+201    0.2547224027E-02   -0.1000000000+201    0.8338640035E-01    0.1686146504E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6182256959     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.25354E-02 d,cutoff=     2.7914         2.8733     max grad=    0.83173E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816376226        0.5361836255E-01
 intlbfgs> Highest QCI image energy=    0.4295910559E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4295910559E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    284   -0.1000000000+201    0.2535448673E-02   -0.1000000000+201    0.8317272864E-01    0.1793523998E-03        15     3
 intlbfgs> Mean deviation     0.5361836255E-01 Decreasing QCI force constant to      1.701386369    
 intlbfgs> largest atomic distance between images is     0.6182874542     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.25319E-02 d,cutoff=     2.7914         2.8733     max grad=    0.82961E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816415807        0.4796127943E-01
 intlbfgs> Highest QCI image energy=    0.4283962312E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4283962312E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    285   -0.1000000000+201    0.2531862223E-02   -0.1000000000+201    0.8296101863E-01    0.1157541879E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6181875914     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.25264E-02 d,cutoff=     2.7915         2.8733     max grad=    0.83057E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816422408        0.6439733602E-01
 intlbfgs> Highest QCI image energy=    0.4281871633E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4281871633E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    286   -0.1000000000+201    0.2526448844E-02   -0.1000000000+201    0.8305723585E-01    0.2991376826E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6183289622     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.25256E-02 d,cutoff=     2.7915         2.8733     max grad=    0.82685E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816474666        0.4513733995E-01
 intlbfgs> Highest QCI image energy=    0.4266276724E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4266276724E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    287   -0.1000000000+201    0.2525554606E-02   -0.1000000000+201    0.8268542317E-01    0.3480407894E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6183347838     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.25246E-02 d,cutoff=     2.7915         2.8733     max grad=    0.82729E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816470844        0.4413592266E-01
 intlbfgs> Highest QCI image energy=    0.4267384499E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4267384499E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    288   -0.1000000000+201    0.2524633578E-02   -0.1000000000+201    0.8272863961E-01    0.1263660528E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6183282640     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.25230E-02 d,cutoff=     2.7916         2.8733     max grad=    0.82730E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816476130        0.4487798532E-01
 intlbfgs> Highest QCI image energy=    0.4265779203E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4265779203E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    289   -0.1000000000+201    0.2523038343E-02   -0.1000000000+201    0.8273007174E-01    0.2734730724E-04        15     3
 intlbfgs> Mean deviation     0.4487798532E-01 Decreasing QCI force constant to      1.684540960    
 intlbfgs> largest atomic distance between images is     0.6183066258     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.25179E-02 d,cutoff=     2.7916         2.8733     max grad=    0.82415E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816534652        0.4766606151E-01
 intlbfgs> Highest QCI image energy=    0.4248159801E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4248159801E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    290   -0.1000000000+201    0.2517870623E-02   -0.1000000000+201    0.8241482187E-01    0.1185917676E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6182671000     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.25084E-02 d,cutoff=     2.7918         2.8733     max grad=    0.81652E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816666941        0.5298653504E-01
 intlbfgs> Highest QCI image energy=    0.4208742680E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4208742680E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    291   -0.1000000000+201    0.2508418023E-02   -0.1000000000+201    0.8165198633E-01    0.2652458765E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6182988965     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.25077E-02 d,cutoff=     2.7918         2.8733     max grad=    0.82006E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816623155        0.4955883884E-01
 intlbfgs> Highest QCI image energy=    0.4221723873E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4221723873E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    292   -0.1000000000+201    0.2507653282E-02   -0.1000000000+201    0.8200602160E-01    0.1177083646E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6183182606     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.25057E-02 d,cutoff=     2.7918         2.8733     max grad=    0.82038E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816625367        0.4771838405E-01
 intlbfgs> Highest QCI image energy=    0.4221083017E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4221083017E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    293   -0.1000000000+201    0.2505730835E-02   -0.1000000000+201    0.8203844255E-01    0.3754243145E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6183354865     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.25040E-02 d,cutoff=     2.7919         2.8733     max grad=    0.82025E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816633218        0.4615454134E-01
 intlbfgs> Highest QCI image energy=    0.4218767697E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4218767697E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    294   -0.1000000000+201    0.2503979145E-02   -0.1000000000+201    0.8202465089E-01    0.3157290009E-04        15     3
 intlbfgs> Mean deviation     0.4615454134E-01 Decreasing QCI force constant to      1.667862336    
 intlbfgs> largest atomic distance between images is     0.6183364589     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.25039E-02 d,cutoff=     2.7919         2.8733     max grad=    0.82021E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816633858        0.4606939507E-01
 intlbfgs> Highest QCI image energy=    0.4218578651E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4218578651E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    295   -0.1000000000+201    0.2503948395E-02   -0.1000000000+201    0.8202083204E-01    0.1774969282E-05        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6183373206     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.25039E-02 d,cutoff=     2.7919         2.8733     max grad=    0.82017E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816634504        0.4599419295E-01
 intlbfgs> Highest QCI image energy=    0.4218387834E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4218387834E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    296   -0.1000000000+201    0.2503893984E-02   -0.1000000000+201    0.8201748215E-01    0.1611198127E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6183748538     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.24908E-02 d,cutoff=     2.7921         2.8733     max grad=    0.81540E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816742016        0.4355678477E-01
 intlbfgs> Highest QCI image energy=    0.4186638952E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4186638952E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    297   -0.1000000000+201    0.2490803796E-02   -0.1000000000+201    0.8153962664E-01    0.2052167776E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6183692099     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.24906E-02 d,cutoff=     2.7921         2.8733     max grad=    0.81530E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816744352        0.4422044684E-01
 intlbfgs> Highest QCI image energy=    0.4185941181E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4185941181E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    298   -0.1000000000+201    0.2490563781E-02   -0.1000000000+201    0.8153042127E-01    0.2474508725E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6183552112     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.24898E-02 d,cutoff=     2.7921         2.8733     max grad=    0.81538E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816745842        0.4565430659E-01
 intlbfgs> Highest QCI image energy=    0.4185485146E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4185485146E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    299   -0.1000000000+201    0.2489826302E-02   -0.1000000000+201    0.8153778707E-01    0.2581024707E-04        15     3
 intlbfgs> Mean deviation     0.4565430659E-01 Decreasing QCI force constant to      1.651348848    
 intlbfgs> largest atomic distance between images is     0.6183566001     for atom     10 and images      1     2 total images=     1
 checkrep> number of active repulsions and total=      56      56
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.24901E-02 d,cutoff=     2.7921         2.8733     max grad=    0.81533E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816745657        0.4551689738E-01
 intlbfgs> Highest QCI image energy=    0.4185541265E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4185541265E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    300   -0.1000000000+201    0.2490105412E-02   -0.1000000000+201    0.8153257053E-01    0.4202988406E-05        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.6184459089     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.25056E-02 d,cutoff=     2.7918         2.8733     max grad=    0.81149E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816748653        0.3686052671E-01
 intlbfgs> Highest QCI image energy=    0.4184944274E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4184944274E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    301   -0.1000000000+201    0.2505607689E-02   -0.1000000000+201    0.8114931554E-01    0.2544469556E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6183594418     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.24903E-02 d,cutoff=     2.7921         2.8733     max grad=    0.81527E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816745963        0.4524673681E-01
 intlbfgs> Highest QCI image energy=    0.4185454441E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4185454441E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    302   -0.1000000000+201    0.2490272941E-02   -0.1000000000+201    0.8152674500E-01    0.2502191904E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6183596223     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.24902E-02 d,cutoff=     2.7921         2.8733     max grad=    0.81527E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816746216        0.4523436938E-01
 intlbfgs> Highest QCI image energy=    0.4185380061E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4185380061E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    303   -0.1000000000+201    0.2490198461E-02   -0.1000000000+201    0.8152678202E-01    0.9649077058E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6183951728     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.24769E-02 d,cutoff=     2.7923         2.8733     max grad=    0.81347E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816816029        0.4284387865E-01
 intlbfgs> Highest QCI image energy=    0.4164953980E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4164953980E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    304   -0.1000000000+201    0.2476923100E-02   -0.1000000000+201    0.8134745813E-01    0.1721659262E-03        15     3
 intlbfgs> Mean deviation     0.4284387865E-01 Decreasing QCI force constant to      1.634998859    
 intlbfgs> largest atomic distance between images is     0.6183789342     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.24767E-02 d,cutoff=     2.7923         2.8733     max grad=    0.80993E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816863008        0.4468275158E-01
 intlbfgs> Highest QCI image energy=    0.4151219068E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4151219068E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    305   -0.1000000000+201    0.2476663472E-02   -0.1000000000+201    0.8099340846E-01    0.1099370096E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6183985363     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.25160E-02 d,cutoff=     2.7917         2.8733     max grad=    0.76516E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8817325210        0.7510741065E-01
 intlbfgs> Highest QCI image energy=    0.4026212050E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4026212050E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    306   -0.1000000000+201    0.2516040424E-02   -0.1000000000+201    0.7651577276E-01    0.1557392291E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6183513739     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.24816E-02 d,cutoff=     2.7922         2.8733     max grad=    0.80793E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816871622        0.4714822606E-01
 intlbfgs> Highest QCI image energy=    0.4148727391E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4148727391E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    307   -0.1000000000+201    0.2481632608E-02   -0.1000000000+201    0.8079346154E-01    0.1467416514E-02        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6183642956     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.24781E-02 d,cutoff=     2.7923         2.8733     max grad=    0.80769E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816887382        0.4617935155E-01
 intlbfgs> Highest QCI image energy=    0.4144141281E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4144141281E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    308   -0.1000000000+201    0.2478088798E-02   -0.1000000000+201    0.8076916832E-01    0.4737345658E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6184075535     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.24624E-02 d,cutoff=     2.7925         2.8733     max grad=    0.80564E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816970408        0.4340602078E-01
 intlbfgs> Highest QCI image energy=    0.4120118063E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4120118063E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    309   -0.1000000000+201    0.2462437160E-02   -0.1000000000+201    0.8056443702E-01    0.2204012351E-03        15     3
 intlbfgs> Mean deviation     0.4340602078E-01 Decreasing QCI force constant to      1.618810752    
 intlbfgs> largest atomic distance between images is     0.6184017771     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.24622E-02 d,cutoff=     2.7925         2.8733     max grad=    0.80565E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816970870        0.4395772445E-01
 intlbfgs> Highest QCI image energy=    0.4119978341E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4119978341E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    310   -0.1000000000+201    0.2462246426E-02   -0.1000000000+201    0.8056487636E-01    0.8429486658E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6185601625     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.24484E-02 d,cutoff=     2.7927         2.8733     max grad=    0.80767E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816980600        0.9710008444E-01
 intlbfgs> Highest QCI image energy=    0.4117558796E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4117558796E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    311   -0.1000000000+201    0.2448416642E-02   -0.1000000000+201    0.8076698292E-01    0.8116476915E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6183928338     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.24621E-02 d,cutoff=     2.7925         2.8733     max grad=    0.80570E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816970588        0.4481566112E-01
 intlbfgs> Highest QCI image energy=    0.4120050307E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4120050307E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    312   -0.1000000000+201    0.2462072222E-02   -0.1000000000+201    0.8057036896E-01    0.8004742692E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6183933590     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.24620E-02 d,cutoff=     2.7925         2.8733     max grad=    0.80570E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8816970958        0.4477389751E-01
 intlbfgs> Highest QCI image energy=    0.4119944150E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4119944150E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    313   -0.1000000000+201    0.2461969754E-02   -0.1000000000+201    0.8057043509E-01    0.1586390479E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6184337683     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.24510E-02 d,cutoff=     2.7927         2.8733     max grad=    0.80336E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8817042463        0.4203174521E-01
 intlbfgs> Highest QCI image energy=    0.4099433856E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4099433856E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    314   -0.1000000000+201    0.2450950379E-02   -0.1000000000+201    0.8033562051E-01    0.1727150302E-03        15     3
 intlbfgs> Mean deviation     0.4203174521E-01 Decreasing QCI force constant to      1.602782922    
 intlbfgs> largest atomic distance between images is     0.6184117217     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.24495E-02 d,cutoff=     2.7927         2.8733     max grad=    0.80005E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8817090100        0.4437049170E-01
 intlbfgs> Highest QCI image energy=    0.4085780478E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4085780478E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    315   -0.1000000000+201    0.2449487821E-02   -0.1000000000+201    0.8000516979E-01    0.1108701273E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6184210774     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.24639E-02 d,cutoff=     2.7925         2.8733     max grad=    0.77153E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8817407655        0.7769088004E-01
 intlbfgs> Highest QCI image energy=    0.3999885190E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3999885190E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    316   -0.1000000000+201    0.2463875023E-02   -0.1000000000+201    0.7715290722E-01    0.1179724867E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6183846963     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.24530E-02 d,cutoff=     2.7927         2.8733     max grad=    0.79867E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8817094530        0.4666276615E-01
 intlbfgs> Highest QCI image energy=    0.4084530031E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4084530031E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    317   -0.1000000000+201    0.2453035083E-02   -0.1000000000+201    0.7986654367E-01    0.1095439891E-02        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6183937031     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.24497E-02 d,cutoff=     2.7927         2.8733     max grad=    0.79839E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8817110279        0.4610714369E-01
 intlbfgs> Highest QCI image energy=    0.4080030596E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4080030596E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    318   -0.1000000000+201    0.2449732104E-02   -0.1000000000+201    0.7983940643E-01    0.4968042113E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6184353458     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.24345E-02 d,cutoff=     2.7930         2.8733     max grad=    0.79605E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8817197389        0.4355342279E-01
 intlbfgs> Highest QCI image energy=    0.4055318288E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4055318288E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    319   -0.1000000000+201    0.2434496441E-02   -0.1000000000+201    0.7960535120E-01    0.2233611509E-03        15     3
 intlbfgs> Mean deviation     0.4355342279E-01 Decreasing QCI force constant to      1.586913785    
 intlbfgs> largest atomic distance between images is     0.6184381825     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.24344E-02 d,cutoff=     2.7930         2.8733     max grad=    0.79602E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8817198043        0.4327811578E-01
 intlbfgs> Highest QCI image energy=    0.4055136387E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4055136387E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    320   -0.1000000000+201    0.2434449047E-02   -0.1000000000+201    0.7960175679E-01    0.4210305758E-05        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6184139339     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.24340E-02 d,cutoff=     2.7930         2.8733     max grad=    0.79610E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8817198408        0.4571402665E-01
 intlbfgs> Highest QCI image energy=    0.4055008853E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4055008853E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    321   -0.1000000000+201    0.2434042816E-02   -0.1000000000+201    0.7960984573E-01    0.3854006914E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6184399709     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.24335E-02 d,cutoff=     2.7930         2.8733     max grad=    0.79619E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8817199290        0.4316605389E-01
 intlbfgs> Highest QCI image energy=    0.4054785603E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4054785603E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    322   -0.1000000000+201    0.2433483842E-02   -0.1000000000+201    0.7961906657E-01    0.3518956746E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6184547409     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.24340E-02 d,cutoff=     2.7930         2.8733     max grad=    0.79589E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8817201297        0.4169080805E-01
 intlbfgs> Highest QCI image energy=    0.4054233923E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4054233923E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    323   -0.1000000000+201    0.2434049230E-02   -0.1000000000+201    0.7958899532E-01    0.2671947821E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6184827968     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.24333E-02 d,cutoff=     2.7930         2.8733     max grad=    0.79548E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8817209694        0.3900217290E-01
 intlbfgs> Highest QCI image energy=    0.4051894309E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4051894309E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    324   -0.1000000000+201    0.2433278563E-02   -0.1000000000+201    0.7954750331E-01    0.4064858093E-04        15     3
 intlbfgs> Mean deviation     0.3900217290E-01 Decreasing QCI force constant to      1.571201767    
 intlbfgs> largest atomic distance between images is     0.6184047315     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.24180E-02 d,cutoff=     2.7932         2.8733     max grad=    0.78946E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8817344517        0.4827237793E-01
 intlbfgs> Highest QCI image energy=    0.4013952822E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4013952822E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    325   -0.1000000000+201    0.2417978403E-02   -0.1000000000+201    0.7894585962E-01    0.2873513452E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6185454775     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.23577E-02 d,cutoff=     2.7942         2.8733     max grad=    0.76943E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8817842959        0.4136928704E-01
 intlbfgs> Highest QCI image energy=    0.3877891833E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3877891833E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    326   -0.1000000000+201    0.2357731870E-02   -0.1000000000+201    0.7694334361E-01    0.9937752998E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6184707114     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.24069E-02 d,cutoff=     2.7934         2.8733     max grad=    0.78635E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8817427590        0.4299392234E-01
 intlbfgs> Highest QCI image energy=    0.3990902064E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3990902064E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    327   -0.1000000000+201    0.2406929228E-02   -0.1000000000+201    0.7863478417E-01    0.8256912569E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6184802850     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.24067E-02 d,cutoff=     2.7934         2.8733     max grad=    0.78642E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8817427428        0.4206683789E-01
 intlbfgs> Highest QCI image energy=    0.3990956262E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3990956262E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    328   -0.1000000000+201    0.2406737154E-02   -0.1000000000+201    0.7864207247E-01    0.1202006596E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6184829557     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.24067E-02 d,cutoff=     2.7934         2.8733     max grad=    0.78643E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8817427435        0.4180959052E-01
 intlbfgs> Highest QCI image energy=    0.3990956892E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3990956892E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    329   -0.1000000000+201    0.2406719004E-02   -0.1000000000+201    0.7864287373E-01    0.3360324076E-05        15     3
 intlbfgs> Mean deviation     0.4180959052E-01 Decreasing QCI force constant to      1.555645314    
 intlbfgs> largest atomic distance between images is     0.6184828605     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.24067E-02 d,cutoff=     2.7934         2.8733     max grad=    0.78644E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8817427464        0.4181935016E-01
 intlbfgs> Highest QCI image energy=    0.3990948838E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3990948838E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    330   -0.1000000000+201    0.2406677296E-02   -0.1000000000+201    0.7864371629E-01    0.6625973536E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6184750912     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.24038E-02 d,cutoff=     2.7935         2.8733     max grad=    0.78717E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8817427502        0.4258403477E-01
 intlbfgs> Highest QCI image energy=    0.3990939012E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3990939012E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    331   -0.1000000000+201    0.2403759699E-02   -0.1000000000+201    0.7871681332E-01    0.5022191448E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6184828515     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.24066E-02 d,cutoff=     2.7934         2.8733     max grad=    0.78645E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8817427457        0.4182607313E-01
 intlbfgs> Highest QCI image energy=    0.3990950712E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3990950712E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    332   -0.1000000000+201    0.2406631838E-02   -0.1000000000+201    0.7864515844E-01    0.5011474441E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6184828708     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.24066E-02 d,cutoff=     2.7934         2.8733     max grad=    0.78645E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8817427467        0.4182353100E-01
 intlbfgs> Highest QCI image energy=    0.3990947876E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3990947876E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    333   -0.1000000000+201    0.2406642195E-02   -0.1000000000+201    0.7864478959E-01    0.2357932808E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6184869246     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.24075E-02 d,cutoff=     2.7934         2.8733     max grad=    0.78605E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8817429582        0.4138313616E-01
 intlbfgs> Highest QCI image energy=    0.3990367715E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3990367715E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    334   -0.1000000000+201    0.2407515517E-02   -0.1000000000+201    0.7860458243E-01    0.2355901510E-04        15     3
 intlbfgs> Mean deviation     0.4138313616E-01 Decreasing QCI force constant to      1.540242885    
 intlbfgs> largest atomic distance between images is     0.6184874122     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.23907E-02 d,cutoff=     2.7937         2.8733     max grad=    0.78154E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8817551378        0.4286756993E-01
 intlbfgs> Highest QCI image energy=    0.3956790332E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3956790332E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    335   -0.1000000000+201    0.2390709435E-02   -0.1000000000+201    0.7815430092E-01    0.2416317115E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6188391856     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.21814E-02 d,cutoff=     2.7972         2.8733     max grad=    0.71190E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8819354909        0.3123403626E-01
 intlbfgs> Highest QCI image energy=    0.3498087177E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3498087177E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    336   -0.1000000000+201    0.2181389136E-02   -0.1000000000+201    0.7119032290E-01    0.3350273616E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6185159872     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.23786E-02 d,cutoff=     2.7939         2.8733     max grad=    0.77698E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8817659012        0.4150136702E-01
 intlbfgs> Highest QCI image energy=    0.3927430044E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3927430044E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    337   -0.1000000000+201    0.2378605770E-02   -0.1000000000+201    0.7769752451E-01    0.3143010952E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6185205549     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.23789E-02 d,cutoff=     2.7939         2.8733     max grad=    0.77692E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8817658900        0.4106051972E-01
 intlbfgs> Highest QCI image energy=    0.3927464540E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3927464540E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    338   -0.1000000000+201    0.2378895011E-02   -0.1000000000+201    0.7769174507E-01    0.7908606377E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6185257169     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.23790E-02 d,cutoff=     2.7939         2.8733     max grad=    0.77691E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8817658913        0.4056403376E-01
 intlbfgs> Highest QCI image energy=    0.3927465763E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3927465763E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    339   -0.1000000000+201    0.2378963425E-02   -0.1000000000+201    0.7769085707E-01    0.6913440638E-05        15     3
 intlbfgs> Mean deviation     0.4056403376E-01 Decreasing QCI force constant to      1.524992955    
 intlbfgs> largest atomic distance between images is     0.6185261129     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.23790E-02 d,cutoff=     2.7939         2.8733     max grad=    0.77691E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8817658927        0.4052406826E-01
 intlbfgs> Highest QCI image energy=    0.3927462187E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3927462187E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    340   -0.1000000000+201    0.2378953823E-02   -0.1000000000+201    0.7769094075E-01    0.6850015177E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6186982786     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.23754E-02 d,cutoff=     2.7939         2.8733     max grad=    0.77750E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8817660211        0.2307612864E-01
 intlbfgs> Highest QCI image energy=    0.3927420283E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3927420283E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    341   -0.1000000000+201    0.2375422900E-02   -0.1000000000+201    0.7774950427E-01    0.3004511415E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6185265445     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.23789E-02 d,cutoff=     2.7939         2.8733     max grad=    0.77692E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8817658918        0.4048167367E-01
 intlbfgs> Highest QCI image energy=    0.3927465140E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3927465140E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    342   -0.1000000000+201    0.2378930424E-02   -0.1000000000+201    0.7769161098E-01    0.2998723618E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6185265560     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.23789E-02 d,cutoff=     2.7939         2.8733     max grad=    0.77692E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8817658929        0.4048123471E-01
 intlbfgs> Highest QCI image energy=    0.3927461990E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3927461990E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    343   -0.1000000000+201    0.2378921395E-02   -0.1000000000+201    0.7769178706E-01    0.1488444592E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6185343522     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.23760E-02 d,cutoff=     2.7939         2.8733     max grad=    0.77723E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8817666121        0.3998519725E-01
 intlbfgs> Highest QCI image energy=    0.3925518291E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3925518291E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    344   -0.1000000000+201    0.2376044277E-02   -0.1000000000+201    0.7772300459E-01    0.4681283830E-04        15     3
 intlbfgs> Mean deviation     0.3998519725E-01 Decreasing QCI force constant to      1.509894015    
 intlbfgs> largest atomic distance between images is     0.6185286790     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.23600E-02 d,cutoff=     2.7942         2.8733     max grad=    0.76839E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8817845808        0.4245932720E-01
 intlbfgs> Highest QCI image energy=    0.3877096419E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3877096419E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    345   -0.1000000000+201    0.2360020020E-02   -0.1000000000+201    0.7683923689E-01    0.3206085390E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6185842391     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.23426E-02 d,cutoff=     2.7945         2.8733     max grad=    0.76400E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8817972457        0.3880967311E-01
 intlbfgs> Highest QCI image energy=    0.3843442481E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3843442481E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    346   -0.1000000000+201    0.2342606504E-02   -0.1000000000+201    0.7640025693E-01    0.2633329002E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6185664153     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.23512E-02 d,cutoff=     2.7943         2.8733     max grad=    0.76742E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8817892857        0.3958288628E-01
 intlbfgs> Highest QCI image energy=    0.3864558796E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3864558796E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    347   -0.1000000000+201    0.2351242754E-02   -0.1000000000+201    0.7674209850E-01    0.1459937583E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6185681303     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.23512E-02 d,cutoff=     2.7943         2.8733     max grad=    0.76744E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8817892519        0.3939535914E-01
 intlbfgs> Highest QCI image energy=    0.3864650541E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3864650541E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    348   -0.1000000000+201    0.2351248734E-02   -0.1000000000+201    0.7674398547E-01    0.5926676170E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6185700340     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.23513E-02 d,cutoff=     2.7943         2.8733     max grad=    0.76744E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8817892502        0.3919042373E-01
 intlbfgs> Highest QCI image energy=    0.3864656917E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3864656917E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    349   -0.1000000000+201    0.2351253362E-02   -0.1000000000+201    0.7674413682E-01    0.7087244008E-05        15     3
 intlbfgs> Mean deviation     0.3919042373E-01 Decreasing QCI force constant to      1.494944570    
 intlbfgs> largest atomic distance between images is     0.6185699847     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.23512E-02 d,cutoff=     2.7943         2.8733     max grad=    0.76745E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8817892524        0.3919425916E-01
 intlbfgs> Highest QCI image energy=    0.3864651051E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3864651051E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    350   -0.1000000000+201    0.2351210904E-02   -0.1000000000+201    0.7674490168E-01    0.7864676963E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6185594198     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.23433E-02 d,cutoff=     2.7945         2.8733     max grad=    0.76912E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8817892901        0.3998667854E-01
 intlbfgs> Highest QCI image energy=    0.3864619043E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3864619043E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    351   -0.1000000000+201    0.2343331102E-02   -0.1000000000+201    0.7691235408E-01    0.1542183796E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6185700059     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.23512E-02 d,cutoff=     2.7943         2.8733     max grad=    0.76746E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8817892507        0.3919293546E-01
 intlbfgs> Highest QCI image energy=    0.3864655489E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3864655489E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    352   -0.1000000000+201    0.2351183966E-02   -0.1000000000+201    0.7674567734E-01    0.1539031338E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6185699900     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.23512E-02 d,cutoff=     2.7943         2.8733     max grad=    0.76745E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8817892524        0.3919443160E-01
 intlbfgs> Highest QCI image energy=    0.3864650887E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3864650887E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    353   -0.1000000000+201    0.2351187447E-02   -0.1000000000+201    0.7674547596E-01    0.9618166117E-07        15     3
 intlbfgs> largest atomic distance between images is     0.6185562081     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.23522E-02 d,cutoff=     2.7943         2.8733     max grad=    0.76562E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8817916024        0.4060204005E-01
 intlbfgs> Highest QCI image energy=    0.3858400100E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3858400100E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    354   -0.1000000000+201    0.2352158169E-02   -0.1000000000+201    0.7656198983E-01    0.7666847216E-04        15     3
 intlbfgs> Mean deviation     0.4060204005E-01 Decreasing QCI force constant to      1.480143138    
 intlbfgs> largest atomic distance between images is     0.6185758925     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.23405E-02 d,cutoff=     2.7945         2.8733     max grad=    0.76317E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8817990611        0.3963472021E-01
 intlbfgs> Highest QCI image energy=    0.3838642125E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3838642125E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    355   -0.1000000000+201    0.2340486617E-02   -0.1000000000+201    0.7631700491E-01    0.1580529081E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6185949495     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.23205E-02 d,cutoff=     2.7948         2.8733     max grad=    0.75217E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8818216612        0.4016231767E-01
 intlbfgs> Highest QCI image energy=    0.3779583784E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3779583784E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    356   -0.1000000000+201    0.2320527110E-02   -0.1000000000+201    0.7521687748E-01    0.3978482749E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6186115363     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.23233E-02 d,cutoff=     2.7948         2.8733     max grad=    0.75800E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8818124910        0.3792332386E-01
 intlbfgs> Highest QCI image energy=    0.3803395271E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3803395271E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    357   -0.1000000000+201    0.2323338877E-02   -0.1000000000+201    0.7580044862E-01    0.1831164212E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6186073251     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.23258E-02 d,cutoff=     2.7948         2.8733     max grad=    0.75800E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8818119232        0.3830935437E-01
 intlbfgs> Highest QCI image energy=    0.3804867013E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3804867013E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    358   -0.1000000000+201    0.2325752674E-02   -0.1000000000+201    0.7579965926E-01    0.5420750903E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6186139917     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.23228E-02 d,cutoff=     2.7948         2.8733     max grad=    0.75809E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8818130651        0.3792422432E-01
 intlbfgs> Highest QCI image energy=    0.3801887054E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3801887054E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    359   -0.1000000000+201    0.2322841603E-02   -0.1000000000+201    0.7580857644E-01    0.4847221922E-04        15     3
 intlbfgs> Mean deviation     0.3792422432E-01 Decreasing QCI force constant to      1.465488256    
 intlbfgs> largest atomic distance between images is     0.6186138696     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.23236E-02 d,cutoff=     2.7948         2.8733     max grad=    0.75803E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8818128232        0.3788909994E-01
 intlbfgs> Highest QCI image energy=    0.3802518482E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3802518482E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    360   -0.1000000000+201    0.2323552431E-02   -0.1000000000+201    0.7580305675E-01    0.1226086781E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6186133067     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.23245E-02 d,cutoff=     2.7948         2.8733     max grad=    0.75744E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8818131243        0.3790540409E-01
 intlbfgs> Highest QCI image energy=    0.3801734997E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3801734997E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    361   -0.1000000000+201    0.2324540918E-02   -0.1000000000+201    0.7574422638E-01    0.3001278150E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6186082966     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.23223E-02 d,cutoff=     2.7948         2.8733     max grad=    0.75650E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8818152040        0.3851913608E-01
 intlbfgs> Highest QCI image energy=    0.3796310454E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3796310454E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    362   -0.1000000000+201    0.2322315297E-02   -0.1000000000+201    0.7565026371E-01    0.4301707802E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6186073136     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.23132E-02 d,cutoff=     2.7950         2.8733     max grad=    0.75368E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8818226807        0.3945900878E-01
 intlbfgs> Highest QCI image energy=    0.3776888147E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3776888147E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    363   -0.1000000000+201    0.2313226718E-02   -0.1000000000+201    0.7536785620E-01    0.1427437863E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6186180243     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.23106E-02 d,cutoff=     2.7950         2.8733     max grad=    0.75326E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8818244208        0.3877970559E-01
 intlbfgs> Highest QCI image energy=    0.3772385885E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3772385885E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    364   -0.1000000000+201    0.2310570953E-02   -0.1000000000+201    0.7532567730E-01    0.5366218403E-04        15     3
 intlbfgs> Mean deviation     0.3877970559E-01 Decreasing QCI force constant to      1.450978471    
 intlbfgs> largest atomic distance between images is     0.6186330088     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.23097E-02 d,cutoff=     2.7950         2.8733     max grad=    0.75335E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8818246883        0.3750252014E-01
 intlbfgs> Highest QCI image energy=    0.3771702846E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3771702846E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    365   -0.1000000000+201    0.2309732940E-02   -0.1000000000+201    0.7533478428E-01    0.3604304745E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6228460483     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.21068E-02 d,cutoff=     2.7985         2.8733     max grad=    0.78728E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8819287718        0.3239366788    
 intlbfgs> Highest QCI image energy=    0.3676518340E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3676518340E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    366   -0.1000000000+201    0.2106795927E-02   -0.1000000000+201    0.7872813929E-01    0.1004261967E-01        15     3
 intlbfgs> largest atomic distance between images is     0.6186513466     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.23090E-02 d,cutoff=     2.7950         2.8733     max grad=    0.75352E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8818248129        0.3589873081E-01
 intlbfgs> Highest QCI image energy=    0.3771396574E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3771396574E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    367   -0.1000000000+201    0.2308989842E-02   -0.1000000000+201    0.7535160947E-01    0.1000309733E-01        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6186514024     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.23089E-02 d,cutoff=     2.7950         2.8733     max grad=    0.75349E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8818248929        0.3590127628E-01
 intlbfgs> Highest QCI image energy=    0.3771189683E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3771189683E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    368   -0.1000000000+201    0.2308887022E-02   -0.1000000000+201    0.7534851481E-01    0.1507522549E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6186570642     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.22959E-02 d,cutoff=     2.7953         2.8733     max grad=    0.74888E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8818361468        0.3654859988E-01
 intlbfgs> Highest QCI image energy=    0.3742238907E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3742238907E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    369   -0.1000000000+201    0.2295915175E-02   -0.1000000000+201    0.7488830851E-01    0.2027343320E-03        15     3
 intlbfgs> Mean deviation     0.3654859988E-01 Decreasing QCI force constant to      1.436612347    
 intlbfgs> largest atomic distance between images is     0.6186581738     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.22960E-02 d,cutoff=     2.7952         2.8733     max grad=    0.74869E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8818364914        0.3651941735E-01
 intlbfgs> Highest QCI image energy=    0.3741355173E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3741355173E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    370   -0.1000000000+201    0.2295963065E-02   -0.1000000000+201    0.7486867229E-01    0.1988211395E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6186652780     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.23019E-02 d,cutoff=     2.7951         2.8733     max grad=    0.74766E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8818369425        0.3639872601E-01
 intlbfgs> Highest QCI image energy=    0.3740331625E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3740331625E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    371   -0.1000000000+201    0.2301927248E-02   -0.1000000000+201    0.7476576461E-01    0.2733961662E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6186600398     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.22965E-02 d,cutoff=     2.7952         2.8733     max grad=    0.74878E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8818362981        0.3637655069E-01
 intlbfgs> Highest QCI image energy=    0.3741850716E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3741850716E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    372   -0.1000000000+201    0.2296470199E-02   -0.1000000000+201    0.7487808761E-01    0.2464226118E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6186602444     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.22959E-02 d,cutoff=     2.7953         2.8733     max grad=    0.74877E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8818365116        0.3637487448E-01
 intlbfgs> Highest QCI image energy=    0.3741304039E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3741304039E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    373   -0.1000000000+201    0.2295899391E-02   -0.1000000000+201    0.7487683281E-01    0.7845113793E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6186660941     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.22849E-02 d,cutoff=     2.7954         2.8733     max grad=    0.74701E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8818429626        0.3651380449E-01
 intlbfgs> Highest QCI image energy=    0.3724851567E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3724851567E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    374   -0.1000000000+201    0.2284907506E-02   -0.1000000000+201    0.7470088138E-01    0.1445060939E-03        15     3
 intlbfgs> Mean deviation     0.3651380449E-01 Decreasing QCI force constant to      1.422388463    
 intlbfgs> largest atomic distance between images is     0.6186736263     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.22835E-02 d,cutoff=     2.7955         2.8733     max grad=    0.74337E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8818489214        0.3649708635E-01
 intlbfgs> Highest QCI image energy=    0.3709709859E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3709709859E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    375   -0.1000000000+201    0.2283479463E-02   -0.1000000000+201    0.7433653471E-01    0.1316045298E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6187137215     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.23044E-02 d,cutoff=     2.7951         2.8733     max grad=    0.72510E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8818699765        0.3555752645E-01
 intlbfgs> Highest QCI image energy=    0.3658678156E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3658678156E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    376   -0.1000000000+201    0.2304414439E-02   -0.1000000000+201    0.7251044329E-01    0.8830683638E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6186678286     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.22892E-02 d,cutoff=     2.7954         2.8733     max grad=    0.74136E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8818496031        0.3698616860E-01
 intlbfgs> Highest QCI image energy=    0.3708024304E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3708024304E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    377   -0.1000000000+201    0.2289241770E-02   -0.1000000000+201    0.7413551017E-01    0.8145224341E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6186712800     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.22847E-02 d,cutoff=     2.7954         2.8733     max grad=    0.74119E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8818515129        0.3688639388E-01
 intlbfgs> Highest QCI image energy=    0.3703173468E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3703173468E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    378   -0.1000000000+201    0.2284739487E-02   -0.1000000000+201    0.7411854505E-01    0.5464776330E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6186979691     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.22684E-02 d,cutoff=     2.7957         2.8733     max grad=    0.73951E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8818603515        0.3562162599E-01
 intlbfgs> Highest QCI image energy=    0.3680898366E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3680898366E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    379   -0.1000000000+201    0.2268362908E-02   -0.1000000000+201    0.7395127072E-01    0.2170011178E-03        15     3
 intlbfgs> Mean deviation     0.3562162599E-01 Decreasing QCI force constant to      1.408305409    
 intlbfgs> largest atomic distance between images is     0.6187022285     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.22682E-02 d,cutoff=     2.7957         2.8733     max grad=    0.73942E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8818605636        0.3527391800E-01
 intlbfgs> Highest QCI image energy=    0.3680368749E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3680368749E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    380   -0.1000000000+201    0.2268247597E-02   -0.1000000000+201    0.7394182343E-01    0.1070789894E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6186867455     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.22671E-02 d,cutoff=     2.7957         2.8733     max grad=    0.73954E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8818607127        0.3664963117E-01
 intlbfgs> Highest QCI image energy=    0.3679987820E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3679987820E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    381   -0.1000000000+201    0.2267125535E-02   -0.1000000000+201    0.7395420909E-01    0.3901584854E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6187025118     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.22648E-02 d,cutoff=     2.7958         2.8733     max grad=    0.73986E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8818613351        0.3542578393E-01
 intlbfgs> Highest QCI image energy=    0.3678438345E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3678438345E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    382   -0.1000000000+201    0.2264840983E-02   -0.1000000000+201    0.7398644193E-01    0.5667967127E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6187159046     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.22644E-02 d,cutoff=     2.7958         2.8733     max grad=    0.73909E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8818627788        0.3444773764E-01
 intlbfgs> Highest QCI image energy=    0.3674830009E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3674830009E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    383   -0.1000000000+201    0.2264389938E-02   -0.1000000000+201    0.7390865061E-01    0.5123427893E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6187272425     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.22599E-02 d,cutoff=     2.7959         2.8733     max grad=    0.73687E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8818678577        0.3406912397E-01
 intlbfgs> Highest QCI image energy=    0.3662151346E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3662151346E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    384   -0.1000000000+201    0.2259931775E-02   -0.1000000000+201    0.7368715731E-01    0.1061225846E-03        15     3
 intlbfgs> Mean deviation     0.3406912397E-01 Decreasing QCI force constant to      1.394361791    
 intlbfgs> largest atomic distance between images is     0.6187175505     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.22552E-02 d,cutoff=     2.7959         2.8733     max grad=    0.73464E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8818725723        0.3521945237E-01
 intlbfgs> Highest QCI image energy=    0.3650392060E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3650392060E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    385   -0.1000000000+201    0.2255186732E-02   -0.1000000000+201    0.7346380965E-01    0.1040153450E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6185820941     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.22445E-02 d,cutoff=     2.7961         2.8733     max grad=    0.72549E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8818870832        0.4692955232E-01
 intlbfgs> Highest QCI image energy=    0.3615861341E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3615861341E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    386   -0.1000000000+201    0.2244542520E-02   -0.1000000000+201    0.7254910579E-01    0.7315722086E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6187037637     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.22554E-02 d,cutoff=     2.7959         2.8733     max grad=    0.73454E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8818722495        0.3616057316E-01
 intlbfgs> Highest QCI image energy=    0.3651209802E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3651209802E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    387   -0.1000000000+201    0.2255405316E-02   -0.1000000000+201    0.7345392736E-01    0.6446567695E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6187070803     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.22530E-02 d,cutoff=     2.7960         2.8733     max grad=    0.73391E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8818742412        0.3620208539E-01
 intlbfgs> Highest QCI image energy=    0.3646251363E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3646251363E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    388   -0.1000000000+201    0.2253010065E-02   -0.1000000000+201    0.7339065266E-01    0.6010669033E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6187313396     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.22410E-02 d,cutoff=     2.7962         2.8733     max grad=    0.73052E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8818841662        0.3534675018E-01
 intlbfgs> Highest QCI image energy=    0.3621729390E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3621729390E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    389   -0.1000000000+201    0.2241008080E-02   -0.1000000000+201    0.7305223578E-01    0.2174445069E-03        15     3
 intlbfgs> Mean deviation     0.3534675018E-01 Decreasing QCI force constant to      1.380556229    
 intlbfgs> largest atomic distance between images is     0.6187410291     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.22410E-02 d,cutoff=     2.7962         2.8733     max grad=    0.73012E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8818847536        0.3449126158E-01
 intlbfgs> Highest QCI image energy=    0.3620288875E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3620288875E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    390   -0.1000000000+201    0.2240950304E-02   -0.1000000000+201    0.7301157288E-01    0.2447356756E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6187017301     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.22378E-02 d,cutoff=     2.7962         2.8733     max grad=    0.73091E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8818849945        0.3831108915E-01
 intlbfgs> Highest QCI image energy=    0.3619693394E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3619693394E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    391   -0.1000000000+201    0.2237837634E-02   -0.1000000000+201    0.7309102542E-01    0.1169926326E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6187439501     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.22408E-02 d,cutoff=     2.7962         2.8733     max grad=    0.72998E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8818850849        0.3432071109E-01
 intlbfgs> Highest QCI image energy=    0.3619476564E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3619476564E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    392   -0.1000000000+201    0.2240753587E-02   -0.1000000000+201    0.7299830968E-01    0.1132538791E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6187504176     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.22406E-02 d,cutoff=     2.7962         2.8733     max grad=    0.72980E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8818853650        0.3370971336E-01
 intlbfgs> Highest QCI image energy=    0.3618791268E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3618791268E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    393   -0.1000000000+201    0.2240594811E-02   -0.1000000000+201    0.7298049405E-01    0.2048098605E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6187863018     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.22380E-02 d,cutoff=     2.7962         2.8733     max grad=    0.72863E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8818880084        0.3059182738E-01
 intlbfgs> Highest QCI image energy=    0.3612331038E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3612331038E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    394   -0.1000000000+201    0.2238041258E-02   -0.1000000000+201    0.7286255191E-01    0.8600013503E-04        15     3
 intlbfgs> Mean deviation     0.3059182738E-01 Decreasing QCI force constant to      1.366887355    
 intlbfgs> largest atomic distance between images is     0.6187487904     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.22270E-02 d,cutoff=     2.7964         2.8733     max grad=    0.72467E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8818981915        0.3527326833E-01
 intlbfgs> Highest QCI image energy=    0.3587419848E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3587419848E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    395   -0.1000000000+201    0.2226996960E-02   -0.1000000000+201    0.7246730728E-01    0.2249778860E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6673847131     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     14 atoms     12     2 value=    0.11123E-02 d,cutoff=     2.5798         2.6298     max grad=    0.12856    
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.9124778472         3.873742689    
 intlbfgs> Highest QCI image energy=    0.2844306654E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2844306654E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    396   -0.1000000000+201    0.1112283657E-02   -0.1000000000+201    0.1285551474         4.114627737            15     3
 intlbfgs> largest atomic distance between images is     0.6186966868     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.22146E-02 d,cutoff=     2.7966         2.8733     max grad=    0.71981E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8819102970        0.4116888573E-01
 intlbfgs> Highest QCI image energy=    0.3558116436E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3558116436E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    397   -0.1000000000+201    0.2214641649E-02   -0.1000000000+201    0.7198089564E-01    0.1997402190            15     3
 intlbfgs> largest atomic distance between images is     0.6187388586     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.22163E-02 d,cutoff=     2.7966         2.8733     max grad=    0.72329E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8819047085        0.3715113331E-01
 intlbfgs> Highest QCI image energy=    0.3571612863E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3571612863E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    398   -0.1000000000+201    0.2216260685E-02   -0.1000000000+201    0.7232905856E-01    0.1321766354E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6187250100     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.22163E-02 d,cutoff=     2.7966         2.8733     max grad=    0.72179E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8819068183        0.3851078133E-01
 intlbfgs> Highest QCI image energy=    0.3566504993E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3566504993E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    399   -0.1000000000+201    0.2216287769E-02   -0.1000000000+201    0.7217937934E-01    0.5127659256E-04        15     3
 intlbfgs> Mean deviation     0.3851078133E-01 Decreasing QCI force constant to      1.353353817    
 intlbfgs> largest atomic distance between images is     0.6187552261     for atom     10 and images      1     2 total images=     1
 checkrep> number of active repulsions and total=      56      56
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.22146E-02 d,cutoff=     2.7966         2.8733     max grad=    0.72137E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8819080638        0.3588343393E-01
 intlbfgs> Highest QCI image energy=    0.3563500900E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3563500900E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    400   -0.1000000000+201    0.2214575367E-02   -0.1000000000+201    0.7213730269E-01    0.6393952234E-04        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.6193797847     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.21907E-02 d,cutoff=     2.7970         2.8733     max grad=    0.72104E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8819180563        0.2012616697E-01
 intlbfgs> Highest QCI image energy=    0.3541835414E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3541835414E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    401   -0.1000000000+201    0.2190696537E-02   -0.1000000000+201    0.7210388940E-01    0.1302142169E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6188292737     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.22155E-02 d,cutoff=     2.7966         2.8733     max grad=    0.72090E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8819083499        0.2917834836E-01
 intlbfgs> Highest QCI image energy=    0.3562857049E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3562857049E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    402   -0.1000000000+201    0.2215474495E-02   -0.1000000000+201    0.7209008851E-01    0.1161428026E-02        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6188335488     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.22164E-02 d,cutoff=     2.7966         2.8733     max grad=    0.72007E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8819091913        0.2895241657E-01
 intlbfgs> Highest QCI image energy=    0.3560839812E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3560839812E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    403   -0.1000000000+201    0.2216425542E-02   -0.1000000000+201    0.7200707740E-01    0.3894640761E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6188393158     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.22151E-02 d,cutoff=     2.7966         2.8733     max grad=    0.71954E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8819105544        0.2867724720E-01
 intlbfgs> Highest QCI image energy=    0.3557561854E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3557561854E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    404   -0.1000000000+201    0.2215075869E-02   -0.1000000000+201    0.7195407600E-01    0.3487209190E-04        15     3
 intlbfgs> Mean deviation     0.2867724720E-01 Decreasing QCI force constant to      1.339954274    
 intlbfgs> largest atomic distance between images is     0.6188095410     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.21987E-02 d,cutoff=     2.7969         2.8733     max grad=    0.71553E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8819229662        0.3250437620E-01
 intlbfgs> Highest QCI image energy=    0.3527778685E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3527778685E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    405   -0.1000000000+201    0.2198680779E-02   -0.1000000000+201    0.7155287953E-01    0.2579559261E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6188415217     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.20967E-02 d,cutoff=     2.7987         2.8733     max grad=    0.68762E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8820076036        0.3872140037E-01
 intlbfgs> Highest QCI image energy=    0.3332931589E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3332931589E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    406   -0.1000000000+201    0.2096679723E-02   -0.1000000000+201    0.6876201912E-01    0.1570751624E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6188286900     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.21856E-02 d,cutoff=     2.7971         2.8733     max grad=    0.71216E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8819334333        0.3205106214E-01
 intlbfgs> Highest QCI image energy=    0.3502927631E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3502927631E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    407   -0.1000000000+201    0.2185616434E-02   -0.1000000000+201    0.7121579374E-01    0.1368868883E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6188361536     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.21857E-02 d,cutoff=     2.7971         2.8733     max grad=    0.71206E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8819335698        0.3139280384E-01
 intlbfgs> Highest QCI image energy=    0.3502607237E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3502607237E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    408   -0.1000000000+201    0.2185701626E-02   -0.1000000000+201    0.7120588315E-01    0.1991109783E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6188459735     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.21858E-02 d,cutoff=     2.7971         2.8733     max grad=    0.71192E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8819337685        0.3049558340E-01
 intlbfgs> Highest QCI image energy=    0.3502142359E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3502142359E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    409   -0.1000000000+201    0.2185761120E-02   -0.1000000000+201    0.7119178641E-01    0.2372469957E-04        15     3
 intlbfgs> Mean deviation     0.3049558340E-01 Decreasing QCI force constant to      1.326687400    
 intlbfgs> largest atomic distance between images is     0.6188466079     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.21857E-02 d,cutoff=     2.7971         2.8733     max grad=    0.71193E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8819337655        0.3042972834E-01
 intlbfgs> Highest QCI image energy=    0.3502149806E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3502149806E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    410   -0.1000000000+201    0.2185720433E-02   -0.1000000000+201    0.7119338175E-01    0.1839187493E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6191255622     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.21663E-02 d,cutoff=     2.7974         2.8733     max grad=    0.71829E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8819343973        0.1688091524E-02
 intlbfgs> Highest QCI image energy=    0.3501883617E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3501883617E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    411   -0.1000000000+201    0.2166263976E-02   -0.1000000000+201    0.7182935432E-01    0.8033666321E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6188471817     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.21857E-02 d,cutoff=     2.7971         2.8733     max grad=    0.71194E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8819337699        0.3036756234E-01
 intlbfgs> Highest QCI image energy=    0.3502139811E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3502139811E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    412   -0.1000000000+201    0.2185691033E-02   -0.1000000000+201    0.7119416436E-01    0.8014883974E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6188471612     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.21857E-02 d,cutoff=     2.7971         2.8733     max grad=    0.71194E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8819337737        0.3036968255E-01
 intlbfgs> Highest QCI image energy=    0.3502130985E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3502130985E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    413   -0.1000000000+201    0.2185684940E-02   -0.1000000000+201    0.7119408077E-01    0.1246369589E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6188359769     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.21750E-02 d,cutoff=     2.7973         2.8733     max grad=    0.70875E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8819428685        0.3191640857E-01
 intlbfgs> Highest QCI image energy=    0.3480714738E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3480714738E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    414   -0.1000000000+201    0.2174991125E-02   -0.1000000000+201    0.7087525146E-01    0.1914807196E-03        15     3
 intlbfgs> Mean deviation     0.3191640857E-01 Decreasing QCI force constant to      1.313551881    
 intlbfgs> largest atomic distance between images is     0.6188645841     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.21728E-02 d,cutoff=     2.7973         2.8733     max grad=    0.70721E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8819460353        0.2974614864E-01
 intlbfgs> Highest QCI image energy=    0.3473299162E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3473299162E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    415   -0.1000000000+201    0.2172826119E-02   -0.1000000000+201    0.7072086765E-01    0.8984390029E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6189878009     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.21755E-02 d,cutoff=     2.7973         2.8733     max grad=    0.70517E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8819480628        0.1940072762E-01
 intlbfgs> Highest QCI image energy=    0.3468861776E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3468861776E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    416   -0.1000000000+201    0.2175546425E-02   -0.1000000000+201    0.7051667657E-01    0.3756009168E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6188565285     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.21744E-02 d,cutoff=     2.7973         2.8733     max grad=    0.70636E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8819464673        0.3062710997E-01
 intlbfgs> Highest QCI image energy=    0.3472292385E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3472292385E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    417   -0.1000000000+201    0.2174378856E-02   -0.1000000000+201    0.7063618106E-01    0.3590731534E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6188524101     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.21755E-02 d,cutoff=     2.7973         2.8733     max grad=    0.70565E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8819469763        0.3092212212E-01
 intlbfgs> Highest QCI image energy=    0.3471111546E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3471111546E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    418   -0.1000000000+201    0.2175508342E-02   -0.1000000000+201    0.7056498077E-01    0.3116178307E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6188484038     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.21745E-02 d,cutoff=     2.7973         2.8733     max grad=    0.70494E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8819483910        0.3146105726E-01
 intlbfgs> Highest QCI image energy=    0.3467809174E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3467809174E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    419   -0.1000000000+201    0.2174481213E-02   -0.1000000000+201    0.7049364967E-01    0.2719278644E-04        15     3
 intlbfgs> Mean deviation     0.3146105726E-01 Decreasing QCI force constant to      1.300546417    
 intlbfgs> largest atomic distance between images is     0.6188619686     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.21614E-02 d,cutoff=     2.7975         2.8733     max grad=    0.70314E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8819566404        0.3169533414E-01
 intlbfgs> Highest QCI image energy=    0.3448581650E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3448581650E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    420   -0.1000000000+201    0.2161420339E-02   -0.1000000000+201    0.7031356050E-01    0.1903256758E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6188130408     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.21844E-02 d,cutoff=     2.7971         2.8733     max grad=    0.69340E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8819601729        0.3481494443E-01
 intlbfgs> Highest QCI image energy=    0.3441164857E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3441164857E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    421   -0.1000000000+201    0.2184412893E-02   -0.1000000000+201    0.6934024724E-01    0.5076634817E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6188970029     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.21354E-02 d,cutoff=     2.7980         2.8733     max grad=    0.69708E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8819762916        0.3244333283E-01
 intlbfgs> Highest QCI image energy=    0.3403530767E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3403530767E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    422   -0.1000000000+201    0.2135420270E-02   -0.1000000000+201    0.6970810645E-01    0.7459494026E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6189303023     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.21548E-02 d,cutoff=     2.7976         2.8733     max grad=    0.70557E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8819568533        0.2650051445E-01
 intlbfgs> Highest QCI image energy=    0.3448192256E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3448192256E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    423   -0.1000000000+201    0.2154778032E-02   -0.1000000000+201    0.7055694503E-01    0.4529147724E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6188958158     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.21493E-02 d,cutoff=     2.7977         2.8733     max grad=    0.69889E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8819681775        0.3064526967E-01
 intlbfgs> Highest QCI image energy=    0.3421941931E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3421941931E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    424   -0.1000000000+201    0.2149280444E-02   -0.1000000000+201    0.6988857748E-01    0.2520049478E-03        15     3
 intlbfgs> Mean deviation     0.3064526967E-01 Decreasing QCI force constant to      1.287669720    
 intlbfgs> largest atomic distance between images is     0.6189053755     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.21464E-02 d,cutoff=     2.7978         2.8733     max grad=    0.69857E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8819699726        0.2978216635E-01
 intlbfgs> Highest QCI image energy=    0.3417813807E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3417813807E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    425   -0.1000000000+201    0.2146428682E-02   -0.1000000000+201    0.6985656671E-01    0.5586819026E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6188816604     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.21468E-02 d,cutoff=     2.7978         2.8733     max grad=    0.69699E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8819717230        0.3249832423E-01
 intlbfgs> Highest QCI image energy=    0.3413830557E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3413830557E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    426   -0.1000000000+201    0.2146758151E-02   -0.1000000000+201    0.6969922133E-01    0.1222209874E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6189012071     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.21433E-02 d,cutoff=     2.7978         2.8733     max grad=    0.69764E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8819725198        0.3011386922E-01
 intlbfgs> Highest QCI image energy=    0.3411974234E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3411974234E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    427   -0.1000000000+201    0.2143254907E-02   -0.1000000000+201    0.6976423520E-01    0.1160330326E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6189238108     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.21393E-02 d,cutoff=     2.7979         2.8733     max grad=    0.69651E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8819761547        0.2766241905E-01
 intlbfgs> Highest QCI image energy=    0.3403664685E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3403664685E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    428   -0.1000000000+201    0.2139317093E-02   -0.1000000000+201    0.6965110925E-01    0.1403188842E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6189357652     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.21280E-02 d,cutoff=     2.7981         2.8733     max grad=    0.69505E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8819831286        0.2744931676E-01
 intlbfgs> Highest QCI image energy=    0.3387783215E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3387783215E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    429   -0.1000000000+201    0.2128040597E-02   -0.1000000000+201    0.6950530440E-01    0.1484855690E-03        15     3
 intlbfgs> Mean deviation     0.2744931676E-01 Decreasing QCI force constant to      1.274920515    
 intlbfgs> largest atomic distance between images is     0.6189363657     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.21312E-02 d,cutoff=     2.7981         2.8733     max grad=    0.69371E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8819837622        0.2779498986E-01
 intlbfgs> Highest QCI image energy=    0.3386330608E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3386330608E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    430   -0.1000000000+201    0.2131236859E-02   -0.1000000000+201    0.6937057518E-01    0.6865671740E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6190166944     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.22471E-02 d,cutoff=     2.7961         2.8733     max grad=    0.62584E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8820415640        0.4146001469E-01
 intlbfgs> Highest QCI image energy=    0.3282555261E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3282555261E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    431   -0.1000000000+201    0.2247065244E-02   -0.1000000000+201    0.6258396187E-01    0.3059982404E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6189422925     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.21327E-02 d,cutoff=     2.7980         2.8733     max grad=    0.69228E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8819852888        0.2778003314E-01
 intlbfgs> Highest QCI image energy=    0.3382875706E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3382875706E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    432   -0.1000000000+201    0.2132733679E-02   -0.1000000000+201    0.6922772393E-01    0.2998033935E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6189447984     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.21320E-02 d,cutoff=     2.7980         2.8733     max grad=    0.69219E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8819857301        0.2761891702E-01
 intlbfgs> Highest QCI image energy=    0.3381874625E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3381874625E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    433   -0.1000000000+201    0.2132027326E-02   -0.1000000000+201    0.6921920895E-01    0.1001322956E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6189824518     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.21177E-02 d,cutoff=     2.7983         2.8733     max grad=    0.68973E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8819957132        0.2532335994E-01
 intlbfgs> Highest QCI image energy=    0.3359330633E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3359330633E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    434   -0.1000000000+201    0.2117657925E-02   -0.1000000000+201    0.6897259555E-01    0.2021930609E-03        15     3
 intlbfgs> Mean deviation     0.2532335994E-01 Decreasing QCI force constant to      1.262297539    
 intlbfgs> largest atomic distance between images is     0.6189750011     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.21174E-02 d,cutoff=     2.7983         2.8733     max grad=    0.68950E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8819961043        0.2587168263E-01
 intlbfgs> Highest QCI image energy=    0.3358446841E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3358446841E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    435   -0.1000000000+201    0.2117402035E-02   -0.1000000000+201    0.6895047504E-01    0.2098378568E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6188933741     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.21189E-02 d,cutoff=     2.7983         2.8733     max grad=    0.68866E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8819962614        0.3160561744E-01
 intlbfgs> Highest QCI image energy=    0.3358116557E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3358116557E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    436   -0.1000000000+201    0.2118860232E-02   -0.1000000000+201    0.6886554058E-01    0.2007061884E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6189664775     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.21173E-02 d,cutoff=     2.7983         2.8733     max grad=    0.68961E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8819959445        0.2648038266E-01
 intlbfgs> Highest QCI image energy=    0.3358803044E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3358803044E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    437   -0.1000000000+201    0.2117316911E-02   -0.1000000000+201    0.6896144013E-01    0.1826891408E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6189696342     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.21167E-02 d,cutoff=     2.7983         2.8733     max grad=    0.68969E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8819961056        0.2624904480E-01
 intlbfgs> Highest QCI image energy=    0.3358442034E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3358442034E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    438   -0.1000000000+201    0.2116727758E-02   -0.1000000000+201    0.6896902802E-01    0.9411659553E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6190011708     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.21110E-02 d,cutoff=     2.7984         2.8733     max grad=    0.68965E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8819988726        0.2401496669E-01
 intlbfgs> Highest QCI image energy=    0.3352248824E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3352248824E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    439   -0.1000000000+201    0.2110993114E-02   -0.1000000000+201    0.6896521746E-01    0.9358850832E-04        15     3
 intlbfgs> Mean deviation     0.2401496669E-01 Decreasing QCI force constant to      1.249799544    
 intlbfgs> largest atomic distance between images is     0.6190032761     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.21032E-02 d,cutoff=     2.7985         2.8733     max grad=    0.68113E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8820145859        0.2528990877E-01
 intlbfgs> Highest QCI image energy=    0.3317223711E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3317223711E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    440   -0.1000000000+201    0.2103167418E-02   -0.1000000000+201    0.6811309706E-01    0.2706180981E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6190374391     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.20818E-02 d,cutoff=     2.7989         2.8733     max grad=    0.67505E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8820332620        0.2409271626E-01
 intlbfgs> Highest QCI image energy=    0.3276115770E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3276115770E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    441   -0.1000000000+201    0.2081846259E-02   -0.1000000000+201    0.6750527646E-01    0.3464530451E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6190265238     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.20905E-02 d,cutoff=     2.7988         2.8733     max grad=    0.68045E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8820215480        0.2398543681E-01
 intlbfgs> Highest QCI image energy=    0.3301800101E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3301800101E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    442   -0.1000000000+201    0.2090464820E-02   -0.1000000000+201    0.6804492575E-01    0.1910658690E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6190240111     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.20902E-02 d,cutoff=     2.7988         2.8733     max grad=    0.68060E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8820214670        0.2419010875E-01
 intlbfgs> Highest QCI image energy=    0.3301977295E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3301977295E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    443   -0.1000000000+201    0.2090170244E-02   -0.1000000000+201    0.6806025301E-01    0.1113581299E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6190204189     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.20901E-02 d,cutoff=     2.7988         2.8733     max grad=    0.68062E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8820214826        0.2450283969E-01
 intlbfgs> Highest QCI image energy=    0.3301941449E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3301941449E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    444   -0.1000000000+201    0.2090077329E-02   -0.1000000000+201    0.6806204365E-01    0.7523992335E-05        15     3
 intlbfgs> Mean deviation     0.2450283969E-01 Decreasing QCI force constant to      1.237425291    
 intlbfgs> largest atomic distance between images is     0.6190180720     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.20901E-02 d,cutoff=     2.7988         2.8733     max grad=    0.68061E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8820214724        0.2470765779E-01
 intlbfgs> Highest QCI image energy=    0.3301962764E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3301962764E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    445   -0.1000000000+201    0.2090127984E-02   -0.1000000000+201    0.6806071728E-01    0.4095391995E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6186924477     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.20957E-02 d,cutoff=     2.7987         2.8733     max grad=    0.67811E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8820218455        0.5326724174E-01
 intlbfgs> Highest QCI image energy=    0.3301349806E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3301349806E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    446   -0.1000000000+201    0.2095676042E-02   -0.1000000000+201    0.6781064874E-01    0.5692998117E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6190156798     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.20902E-02 d,cutoff=     2.7988         2.8733     max grad=    0.68058E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8820214868        0.2492100433E-01
 intlbfgs> Highest QCI image energy=    0.3301930187E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3301930187E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    447   -0.1000000000+201    0.2090185338E-02   -0.1000000000+201    0.6805764828E-01    0.5651466653E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6190157070     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.20901E-02 d,cutoff=     2.7988         2.8733     max grad=    0.68059E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8820214995        0.2491941376E-01
 intlbfgs> Highest QCI image energy=    0.3301902124E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3301902124E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    448   -0.1000000000+201    0.2090104709E-02   -0.1000000000+201    0.6805919537E-01    0.1154832122E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6190162299     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.20865E-02 d,cutoff=     2.7988         2.8733     max grad=    0.68100E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8820224967        0.2495441616E-01
 intlbfgs> Highest QCI image energy=    0.3299709197E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3299709197E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    449   -0.1000000000+201    0.2086527148E-02   -0.1000000000+201    0.6810000845E-01    0.4963708187E-04        15     3
 intlbfgs> Mean deviation     0.2495441616E-01 Decreasing QCI force constant to      1.225173555    
 intlbfgs> largest atomic distance between images is     0.6190685132     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.20738E-02 d,cutoff=     2.7991         2.8733     max grad=    0.67419E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8820382572        0.2179816188E-01
 intlbfgs> Highest QCI image energy=    0.3265223004E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3265223004E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    450   -0.1000000000+201    0.2073758973E-02   -0.1000000000+201    0.6741894709E-01    0.2649767834E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6191419038     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.20323E-02 d,cutoff=     2.7998         2.8733     max grad=    0.66015E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8820787319        0.1969773174E-01
 intlbfgs> Highest QCI image energy=    0.3178518150E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3178518150E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    451   -0.1000000000+201    0.2032330375E-02   -0.1000000000+201    0.6601498393E-01    0.7252188188E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6190776910     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.20631E-02 d,cutoff=     2.7992         2.8733     max grad=    0.67169E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8820470466        0.2207237201E-01
 intlbfgs> Highest QCI image energy=    0.3246149885E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3246149885E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    452   -0.1000000000+201    0.2063122782E-02   -0.1000000000+201    0.6716904038E-01    0.5485462153E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6190737539     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.20630E-02 d,cutoff=     2.7992         2.8733     max grad=    0.67180E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8820469989        0.2246592968E-01
 intlbfgs> Highest QCI image energy=    0.3246250731E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3246250731E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    453   -0.1000000000+201    0.2062965687E-02   -0.1000000000+201    0.6717959721E-01    0.1410066639E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6190693720     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.20629E-02 d,cutoff=     2.7992         2.8733     max grad=    0.67181E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8820470042        0.2289877492E-01
 intlbfgs> Highest QCI image energy=    0.3246237057E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3246237057E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    454   -0.1000000000+201    0.2062927050E-02   -0.1000000000+201    0.6718143490E-01    0.1077715354E-04        15     3
 intlbfgs> Mean deviation     0.2289877492E-01 Decreasing QCI force constant to      1.213043124    
 intlbfgs> largest atomic distance between images is     0.6190683825     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.20630E-02 d,cutoff=     2.7992         2.8733     max grad=    0.67180E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8820470024        0.2299689455E-01
 intlbfgs> Highest QCI image energy=    0.3246240683E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3246240683E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    455   -0.1000000000+201    0.2062980105E-02   -0.1000000000+201    0.6717962674E-01    0.2415935808E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6192492908     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.21375E-02 d,cutoff=     2.7979         2.8733     max grad=    0.64410E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8820539714        0.1659925842    
 intlbfgs> Highest QCI image energy=    0.3246819777E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3246819777E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    456   -0.1000000000+201    0.2137481508E-02   -0.1000000000+201    0.6441007463E-01    0.3512680754E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6190674614     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.20630E-02 d,cutoff=     2.7992         2.8733     max grad=    0.67178E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8820470054        0.2309079698E-01
 intlbfgs> Highest QCI image energy=    0.3246233759E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3246233759E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    457   -0.1000000000+201    0.2063005066E-02   -0.1000000000+201    0.6717835143E-01    0.3510423425E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6190674864     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.20630E-02 d,cutoff=     2.7992         2.8733     max grad=    0.67178E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8820470079        0.2308933276E-01
 intlbfgs> Highest QCI image energy=    0.3246228395E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3246228395E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    458   -0.1000000000+201    0.2063013044E-02   -0.1000000000+201    0.6717797581E-01    0.2335283305E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6190733062     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.20638E-02 d,cutoff=     2.7992         2.8733     max grad=    0.67106E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8820478021        0.2278576630E-01
 intlbfgs> Highest QCI image energy=    0.3244517545E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3244517545E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    459   -0.1000000000+201    0.2063803452E-02   -0.1000000000+201    0.6710613281E-01    0.4000347989E-04        15     3
 intlbfgs> Mean deviation     0.2278576630E-01 Decreasing QCI force constant to      1.201032796    
 intlbfgs> largest atomic distance between images is     0.6191107992     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.20508E-02 d,cutoff=     2.7995         2.8733     max grad=    0.66697E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8820597145        0.2019624822E-01
 intlbfgs> Highest QCI image energy=    0.3218920609E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3218920609E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    460   -0.1000000000+201    0.2050808243E-02   -0.1000000000+201    0.6669712133E-01    0.2079885925E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6222927848     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.11500E-02 d,cutoff=     2.8178         2.8733     max grad=    0.41338E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8832125546        0.1815917691    
 intlbfgs> Highest QCI image energy=    0.1610126256E-02 images=       1
 intlbfgs> Highest image        2 energy     0.1610126256E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    461   -0.1000000000+201    0.1149952309E-02   -0.1000000000+201    0.4133796976E-01    0.1703801450E-01        15     3
 intlbfgs> largest atomic distance between images is     0.6191437849     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.20370E-02 d,cutoff=     2.7997         2.8733     max grad=    0.66321E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8820716953        0.1826856772E-01
 intlbfgs> Highest QCI image energy=    0.3193414777E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3193414777E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    462   -0.1000000000+201    0.2037045626E-02   -0.1000000000+201    0.6632139860E-01    0.1682932285E-01        15     3
 intlbfgs> largest atomic distance between images is     0.6191401938     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.20368E-02 d,cutoff=     2.7997         2.8733     max grad=    0.66332E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8820717311        0.1872354737E-01
 intlbfgs> Highest QCI image energy=    0.3193330256E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3193330256E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    463   -0.1000000000+201    0.2036780393E-02   -0.1000000000+201    0.6633165573E-01    0.2232476795E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6191207166     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.20363E-02 d,cutoff=     2.7997         2.8733     max grad=    0.66300E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8820726549        0.2109566522E-01
 intlbfgs> Highest QCI image energy=    0.3191351569E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3191351569E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    464   -0.1000000000+201    0.2036291789E-02   -0.1000000000+201    0.6629992142E-01    0.8909391714E-04        15     3
 intlbfgs> Mean deviation     0.2109566522E-01 Decreasing QCI force constant to      1.189141382    
 intlbfgs> largest atomic distance between images is     0.6191199976     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.20356E-02 d,cutoff=     2.7997         2.8733     max grad=    0.66314E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8820727316        0.2119254219E-01
 intlbfgs> Highest QCI image energy=    0.3191188654E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3191188654E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    465   -0.1000000000+201    0.2035634512E-02   -0.1000000000+201    0.6631436746E-01    0.1055271443E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6190431822     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19766E-02 d,cutoff=     2.8008         2.8733     max grad=    0.67893E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8820760516        0.3074851836E-01
 intlbfgs> Highest QCI image energy=    0.3187028169E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3187028169E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    466   -0.1000000000+201    0.1976629415E-02   -0.1000000000+201    0.6789320688E-01    0.1009549453E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6191194237     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.20353E-02 d,cutoff=     2.7997         2.8733     max grad=    0.66326E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8820727017        0.2125179423E-01
 intlbfgs> Highest QCI image energy=    0.3191252039E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3191252039E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    467   -0.1000000000+201    0.2035311835E-02   -0.1000000000+201    0.6632558755E-01    0.1003535394E-02        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6191195426     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.20353E-02 d,cutoff=     2.7997         2.8733     max grad=    0.66324E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8820727483        0.2124540634E-01
 intlbfgs> Highest QCI image energy=    0.3191153378E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3191153378E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    468   -0.1000000000+201    0.2035278501E-02   -0.1000000000+201    0.6632354484E-01    0.7706893520E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6191481889     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.20233E-02 d,cutoff=     2.7999         2.8733     max grad=    0.65864E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8820853661        0.2000367235E-01
 intlbfgs> Highest QCI image energy=    0.3164554129E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3164554129E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    469   -0.1000000000+201    0.2023281888E-02   -0.1000000000+201    0.6586437706E-01    0.2151857676E-03        15     3
 intlbfgs> Mean deviation     0.2000367235E-01 Decreasing QCI force constant to      1.177367705    
 intlbfgs> largest atomic distance between images is     0.6191476190     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.20227E-02 d,cutoff=     2.8000         2.8733     max grad=    0.65868E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8820855952        0.2010552769E-01
 intlbfgs> Highest QCI image energy=    0.3164072060E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3164072060E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    470   -0.1000000000+201    0.2022694701E-02   -0.1000000000+201    0.6586778378E-01    0.1503543519E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6191277673     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.20154E-02 d,cutoff=     2.8001         2.8733     max grad=    0.66077E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8820859764        0.2242679795E-01
 intlbfgs> Highest QCI image energy=    0.3163374207E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3163374207E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    471   -0.1000000000+201    0.2015383850E-02   -0.1000000000+201    0.6607722337E-01    0.2629816829E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6191447434     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.20224E-02 d,cutoff=     2.8000         2.8733     max grad=    0.65886E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8820854567        0.2037942584E-01
 intlbfgs> Highest QCI image energy=    0.3164361377E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3164361377E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    472   -0.1000000000+201    0.2022387037E-02   -0.1000000000+201    0.6588621129E-01    0.2423506979E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6191454456     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.20224E-02 d,cutoff=     2.8000         2.8733     max grad=    0.65877E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8820856127        0.2032848340E-01
 intlbfgs> Highest QCI image energy=    0.3164034337E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3164034337E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    473   -0.1000000000+201    0.2022357570E-02   -0.1000000000+201    0.6587684541E-01    0.4700116989E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6191702034     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.20163E-02 d,cutoff=     2.8001         2.8733     max grad=    0.65549E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8820934625        0.1892380813E-01
 intlbfgs> Highest QCI image energy=    0.3147633731E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3147633731E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    474   -0.1000000000+201    0.2016322813E-02   -0.1000000000+201    0.6554868403E-01    0.1526730054E-03        15     3
 intlbfgs> Mean deviation     0.1892380813E-01 Decreasing QCI force constant to      1.165710599    
 intlbfgs> largest atomic distance between images is     0.6191661269     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.20090E-02 d,cutoff=     2.8002         2.8733     max grad=    0.65439E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8820984965        0.1991714317E-01
 intlbfgs> Highest QCI image energy=    0.3137140098E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3137140098E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    475   -0.1000000000+201    0.2009031682E-02   -0.1000000000+201    0.6543925749E-01    0.1393255350E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6192030201     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.20141E-02 d,cutoff=     2.8001         2.8733     max grad=    0.65148E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8821006428        0.1654177154E-01
 intlbfgs> Highest QCI image energy=    0.3132831676E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3132831676E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    476   -0.1000000000+201    0.2014064181E-02   -0.1000000000+201    0.6514841665E-01    0.2887822479E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6191606330     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.20046E-02 d,cutoff=     2.8003         2.8733     max grad=    0.65191E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8821040099        0.2082152678E-01
 intlbfgs> Highest QCI image energy=    0.3125715488E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3125715488E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    477   -0.1000000000+201    0.2004580529E-02   -0.1000000000+201    0.6519082491E-01    0.3109044840E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6191843702     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19978E-02 d,cutoff=     2.8004         2.8733     max grad=    0.65169E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8821080431        0.1934925048E-01
 intlbfgs> Highest QCI image energy=    0.3117383793E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3117383793E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    478   -0.1000000000+201    0.1997756739E-02   -0.1000000000+201    0.6516923001E-01    0.1289436594E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6191949851     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19953E-02 d,cutoff=     2.8004         2.8733     max grad=    0.65003E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8821117332        0.1874237611E-01
 intlbfgs> Highest QCI image energy=    0.3109785369E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3109785369E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    479   -0.1000000000+201    0.1995335513E-02   -0.1000000000+201    0.6500264506E-01    0.6510769274E-04        15     3
 intlbfgs> Mean deviation     0.1874237611E-01 Decreasing QCI force constant to      1.154168910    
 intlbfgs> largest atomic distance between images is     0.6191939111     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19953E-02 d,cutoff=     2.8004         2.8733     max grad=    0.65012E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8821116466        0.1882106225E-01
 intlbfgs> Highest QCI image energy=    0.3109962373E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3109962373E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    480   -0.1000000000+201    0.1995279080E-02   -0.1000000000+201    0.6501172140E-01    0.1566183446E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6191564406     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19874E-02 d,cutoff=     2.8006         2.8733     max grad=    0.65243E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8821133933        0.2195877221E-01
 intlbfgs> Highest QCI image energy=    0.3106993643E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3106993643E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    481   -0.1000000000+201    0.1987358944E-02   -0.1000000000+201    0.6524289923E-01    0.7181880583E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6191956974     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19952E-02 d,cutoff=     2.8004         2.8733     max grad=    0.65009E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8821118226        0.1866184165E-01
 intlbfgs> Highest QCI image energy=    0.3109601103E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3109601103E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    482   -0.1000000000+201    0.1995239462E-02   -0.1000000000+201    0.6500907211E-01    0.6908799637E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6191966261     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19950E-02 d,cutoff=     2.8005         2.8733     max grad=    0.65008E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8821119393        0.1858530944E-01
 intlbfgs> Highest QCI image energy=    0.3109361302E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3109361302E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    483   -0.1000000000+201    0.1994968365E-02   -0.1000000000+201    0.6500842337E-01    0.4597923841E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6192306616     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19860E-02 d,cutoff=     2.8006         2.8733     max grad=    0.64853E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8821180529        0.1601181239E-01
 intlbfgs> Highest QCI image energy=    0.3096840047E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3096840047E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    484   -0.1000000000+201    0.1986035429E-02   -0.1000000000+201    0.6485349375E-01    0.1384512016E-03        15     3
 intlbfgs> Mean deviation     0.1601181239E-01 Decreasing QCI force constant to      1.142741495    
 intlbfgs> largest atomic distance between images is     0.6192255960     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19837E-02 d,cutoff=     2.8007         2.8733     max grad=    0.64495E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8821250417        0.1723498578E-01
 intlbfgs> Highest QCI image energy=    0.3082564520E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3082564520E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    485   -0.1000000000+201    0.1983735368E-02   -0.1000000000+201    0.6449500182E-01    0.1427378778E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6190598833     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19972E-02 d,cutoff=     2.8004         2.8733     max grad=    0.62058E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8821626213        0.3710347875E-01
 intlbfgs> Highest QCI image energy=    0.3009776128E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3009776128E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    486   -0.1000000000+201    0.1997239364E-02   -0.1000000000+201    0.6205833351E-01    0.1252034078E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6192046313     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19879E-02 d,cutoff=     2.8006         2.8733     max grad=    0.64280E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8821266181        0.1926669420E-01
 intlbfgs> Highest QCI image energy=    0.3079397935E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3079397935E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    487   -0.1000000000+201    0.1987936152E-02   -0.1000000000+201    0.6427957397E-01    0.1160784353E-02        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6192153641     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19840E-02 d,cutoff=     2.8007         2.8733     max grad=    0.64271E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8821285224        0.1849904848E-01
 intlbfgs> Highest QCI image energy=    0.3075510563E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3075510563E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    488   -0.1000000000+201    0.1984003840E-02   -0.1000000000+201    0.6427105216E-01    0.5349951421E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6192534264     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19684E-02 d,cutoff=     2.8009         2.8733     max grad=    0.64170E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8821376969        0.1626061298E-01
 intlbfgs> Highest QCI image energy=    0.3056920886E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3056920886E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    489   -0.1000000000+201    0.1968391558E-02   -0.1000000000+201    0.6417038557E-01    0.2320549058E-03        15     3
 intlbfgs> Mean deviation     0.1626061298E-01 Decreasing QCI force constant to      1.131427223    
 intlbfgs> largest atomic distance between images is     0.6192520110     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19684E-02 d,cutoff=     2.8009         2.8733     max grad=    0.64152E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8821379500        0.1643210888E-01
 intlbfgs> Highest QCI image energy=    0.3056409484E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3056409484E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    490   -0.1000000000+201    0.1968445541E-02   -0.1000000000+201    0.6415232237E-01    0.1705806910E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6192290333     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19725E-02 d,cutoff=     2.8009         2.8733     max grad=    0.64002E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8821381931        0.1866677368E-01
 intlbfgs> Highest QCI image energy=    0.3055972335E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3055972335E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    491   -0.1000000000+201    0.1972478818E-02   -0.1000000000+201    0.6400247449E-01    0.2210167915E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6192493455     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19680E-02 d,cutoff=     2.8009         2.8733     max grad=    0.64178E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8821378933        0.1678126766E-01
 intlbfgs> Highest QCI image energy=    0.3056523875E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3056523875E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    492   -0.1000000000+201    0.1968040361E-02   -0.1000000000+201    0.6417842403E-01    0.2004342847E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6192527557     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19669E-02 d,cutoff=     2.8010         2.8733     max grad=    0.64209E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8821380676        0.1657141747E-01
 intlbfgs> Highest QCI image energy=    0.3056177230E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3056177230E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    493   -0.1000000000+201    0.1966944090E-02   -0.1000000000+201    0.6420864901E-01    0.2957975575E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6192509038     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19679E-02 d,cutoff=     2.8009         2.8733     max grad=    0.64183E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8821379151        0.1666866675E-01
 intlbfgs> Highest QCI image energy=    0.3056481239E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3056481239E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    494   -0.1000000000+201    0.1967927835E-02   -0.1000000000+201    0.6418265717E-01    0.2124949086E-04        15     3
 intlbfgs> Mean deviation     0.1666866675E-01 Decreasing QCI force constant to      1.120224973    
 intlbfgs> largest atomic distance between images is     0.6192865507     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19508E-02 d,cutoff=     2.8013         2.8733     max grad=    0.63597E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8821552579        0.1515065366E-01
 intlbfgs> Highest QCI image energy=    0.3021748458E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3021748458E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    495   -0.1000000000+201    0.1950750767E-02   -0.1000000000+201    0.6359705503E-01    0.2962287989E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6193669795     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19138E-02 d,cutoff=     2.8019         2.8733     max grad=    0.62305E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8821944959        0.1245388970E-01
 intlbfgs> Highest QCI image energy=    0.2944828543E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2944828543E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    496   -0.1000000000+201    0.1913829304E-02   -0.1000000000+201    0.6230487315E-01    0.7100969908E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6193043214     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19417E-02 d,cutoff=     2.8014         2.8733     max grad=    0.63310E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8821643247        0.1462998927E-01
 intlbfgs> Highest QCI image energy=    0.3003766261E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3003766261E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    497   -0.1000000000+201    0.1941721326E-02   -0.1000000000+201    0.6330956950E-01    0.5447674286E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6193033774     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19417E-02 d,cutoff=     2.8014         2.8733     max grad=    0.63308E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8821643261        0.1471757788E-01
 intlbfgs> Highest QCI image energy=    0.3003762961E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3003762961E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    498   -0.1000000000+201    0.1941743966E-02   -0.1000000000+201    0.6330762559E-01    0.8520089606E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6193023271     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19418E-02 d,cutoff=     2.8014         2.8733     max grad=    0.63303E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8821643291        0.1481376268E-01
 intlbfgs> Highest QCI image energy=    0.3003756786E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3003756786E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    499   -0.1000000000+201    0.1941833827E-02   -0.1000000000+201    0.6330317917E-01    0.8761971071E-05        15     3
 intlbfgs> Mean deviation     0.1481376268E-01 Decreasing QCI force constant to      1.109133637    
 intlbfgs> largest atomic distance between images is     0.6193024664     for atom     10 and images      1     2 total images=     1
 checkrep> number of active repulsions and total=      56      56
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19417E-02 d,cutoff=     2.8014         2.8733     max grad=    0.63306E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8821643467        0.1480207389E-01
 intlbfgs> Highest QCI image energy=    0.3003721904E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3003721904E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    500   -0.1000000000+201    0.1941718883E-02   -0.1000000000+201    0.6330560557E-01    0.1917224789E-05        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6192998857     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19441E-02 d,cutoff=     2.8014         2.8733     max grad=    0.63232E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8821643379        0.1506216371E-01
 intlbfgs> Highest QCI image energy=    0.3003744841E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3003744841E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    501   -0.1000000000+201    0.1944129267E-02   -0.1000000000+201    0.6323226734E-01    0.4619391261E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6193027736     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19416E-02 d,cutoff=     2.8014         2.8733     max grad=    0.63309E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8821643521        0.1478850529E-01
 intlbfgs> Highest QCI image energy=    0.3003711426E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3003711426E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    502   -0.1000000000+201    0.1941630229E-02   -0.1000000000+201    0.6330917688E-01    0.4638921956E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6193026947     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19417E-02 d,cutoff=     2.8014         2.8733     max grad=    0.63308E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8821643515        0.1479387023E-01
 intlbfgs> Highest QCI image energy=    0.3003712574E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3003712574E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    503   -0.1000000000+201    0.1941651717E-02   -0.1000000000+201    0.6330835986E-01    0.8256439410E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6193027981     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19417E-02 d,cutoff=     2.8014         2.8733     max grad=    0.63308E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8821643575        0.1478501526E-01
 intlbfgs> Highest QCI image energy=    0.3003700584E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3003700584E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    504   -0.1000000000+201    0.1941652404E-02   -0.1000000000+201    0.6330809934E-01    0.1128213521E-05        15     3
 intlbfgs> Mean deviation     0.1478501526E-01 Decreasing QCI force constant to      1.098152116    
 intlbfgs> largest atomic distance between images is     0.6193591178     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19079E-02 d,cutoff=     2.8020         2.8733     max grad=    0.62279E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8821971453        0.1311492462E-01
 intlbfgs> Highest QCI image energy=    0.2939696853E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2939696853E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    505   -0.1000000000+201    0.1907898746E-02   -0.1000000000+201    0.6227881423E-01    0.5650181804E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6193473330     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19192E-02 d,cutoff=     2.8018         2.8733     max grad=    0.62595E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8821867577        0.1318279806E-01
 intlbfgs> Highest QCI image energy=    0.2959801144E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2959801144E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    506   -0.1000000000+201    0.1919241114E-02   -0.1000000000+201    0.6259527882E-01    0.1888667366E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6193556279     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19151E-02 d,cutoff=     2.8019         2.8733     max grad=    0.62462E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8821909493        0.1288280234E-01
 intlbfgs> Highest QCI image energy=    0.2951667456E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2951667456E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    507   -0.1000000000+201    0.1915090441E-02   -0.1000000000+201    0.6246221384E-01    0.7211079856E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6193558453     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19151E-02 d,cutoff=     2.8019         2.8733     max grad=    0.62463E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8821909573        0.1287856052E-01
 intlbfgs> Highest QCI image energy=    0.2951651976E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2951651976E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    508   -0.1000000000+201    0.1915074851E-02   -0.1000000000+201    0.6246287296E-01    0.3183119613E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6193559520     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19151E-02 d,cutoff=     2.8019         2.8733     max grad=    0.62461E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8821909608        0.1288835377E-01
 intlbfgs> Highest QCI image energy=    0.2951645287E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2951645287E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    509   -0.1000000000+201    0.1915145902E-02   -0.1000000000+201    0.6246116344E-01    0.3294179729E-05        15     3
 intlbfgs> Mean deviation     0.1288835377E-01 Decreasing QCI force constant to      1.087279323    
 intlbfgs> largest atomic distance between images is     0.6193560242     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19151E-02 d,cutoff=     2.8019         2.8733     max grad=    0.62463E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8821909610        0.1288363601E-01
 intlbfgs> Highest QCI image energy=    0.2951644921E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2951644921E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    510   -0.1000000000+201    0.1915087895E-02   -0.1000000000+201    0.6246298260E-01    0.9701200300E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6521673478     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     45 atoms      2    10 value=    0.30531E-01 d,cutoff=     1.3698         1.5126     max grad=    0.50937    
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.9045970931        0.9136919743    
 intlbfgs> Highest QCI image energy=    0.6637607511E-01 images=       1
 intlbfgs> Highest image        2 energy     0.6637607511E-01 is      0.000000000     sigma from the mean
 intlbfgs> steps:    511   -0.1000000000+201    0.3053115230E-01   -0.1000000000+201    0.5093706908        0.2608400606            15     3
 intlbfgs> largest atomic distance between images is     0.6193560708     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19150E-02 d,cutoff=     2.8019         2.8733     max grad=    0.62464E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8821909613        0.1288018612E-01
 intlbfgs> Highest QCI image energy=    0.2951644341E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2951644341E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    512   -0.1000000000+201    0.1915043993E-02   -0.1000000000+201    0.6246430062E-01    0.1999992793            15     3
 intlbfgs> largest atomic distance between images is     0.6193560642     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19150E-02 d,cutoff=     2.8019         2.8733     max grad=    0.62464E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8821909613        0.1288095720E-01
 intlbfgs> Highest QCI image energy=    0.2951644205E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2951644205E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    513   -0.1000000000+201    0.1915049057E-02   -0.1000000000+201    0.6246415186E-01    0.8673557802E-07        15     3
 intlbfgs> largest atomic distance between images is     0.6193557627     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19152E-02 d,cutoff=     2.8019         2.8733     max grad=    0.62458E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8821909686        0.1292496915E-01
 intlbfgs> Highest QCI image energy=    0.2951630058E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2951630058E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    514   -0.1000000000+201    0.1915249100E-02   -0.1000000000+201    0.6245821425E-01    0.3689421156E-05        15     3
 intlbfgs> Mean deviation     0.1292496915E-01 Decreasing QCI force constant to      1.076514181    
 intlbfgs> largest atomic distance between images is     0.6193717424     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19030E-02 d,cutoff=     2.8021         2.8733     max grad=    0.61998E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8822042009        0.1298391458E-01
 intlbfgs> Highest QCI image energy=    0.2926127202E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2926127202E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    515   -0.1000000000+201    0.1902977155E-02   -0.1000000000+201    0.6199756630E-01    0.2117654626E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6198716040     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.16061E-02 d,cutoff=     2.8078         2.8733     max grad=    0.51342E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8825440759        0.6441942779E-02
 intlbfgs> Highest QCI image energy=    0.2350632802E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2350632802E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    516   -0.1000000000+201    0.1606133279E-02   -0.1000000000+201    0.5134165611E-01    0.5301321209E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6193972610     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18899E-02 d,cutoff=     2.8024         2.8733     max grad=    0.61599E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8822172414        0.1221079138E-01
 intlbfgs> Highest QCI image energy=    0.2901228694E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2901228694E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    517   -0.1000000000+201    0.1889920092E-02   -0.1000000000+201    0.6159878356E-01    0.5079081209E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6194014000     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18894E-02 d,cutoff=     2.8024         2.8733     max grad=    0.61612E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8822174041        0.1183435243E-01
 intlbfgs> Highest QCI image energy=    0.2900914894E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2900914894E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    518   -0.1000000000+201    0.1889410252E-02   -0.1000000000+201    0.6161162248E-01    0.2655682836E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6194092017     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18886E-02 d,cutoff=     2.8024         2.8733     max grad=    0.61627E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8822177794        0.1107372735E-01
 intlbfgs> Highest QCI image energy=    0.2900199687E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2900199687E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    519   -0.1000000000+201    0.1888564474E-02   -0.1000000000+201    0.6162670151E-01    0.4564094658E-04        15     3
 intlbfgs> Mean deviation     0.1107372735E-01 Decreasing QCI force constant to      1.065855625    
 intlbfgs> largest atomic distance between images is     0.6194097525     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18885E-02 d,cutoff=     2.8024         2.8733     max grad=    0.61628E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8822177812        0.1099103616E-01
 intlbfgs> Highest QCI image energy=    0.2900196502E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2900196502E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    520   -0.1000000000+201    0.1888517557E-02   -0.1000000000+201    0.6162815401E-01    0.2547675334E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6361350973     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     45 atoms      2    10 value=    0.14330E-02 d,cutoff=     1.4800         1.5126     max grad=    0.10783    
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8852509524         2.438806815    
 intlbfgs> Highest QCI image energy=    0.4137580917E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4137580917E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    521   -0.1000000000+201    0.1432977881E-02   -0.1000000000+201    0.1078303768        0.7602572854E-01        15     3
 intlbfgs> largest atomic distance between images is     0.6194106810     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18885E-02 d,cutoff=     2.8024         2.8733     max grad=    0.61628E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8822177819        0.1084094908E-01
 intlbfgs> Highest QCI image energy=    0.2900195389E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2900195389E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    522   -0.1000000000+201    0.1888521839E-02   -0.1000000000+201    0.6162799209E-01    0.7602119432E-01        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6194107342     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18886E-02 d,cutoff=     2.8024         2.8733     max grad=    0.61627E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8822177827        0.1082622979E-01
 intlbfgs> Highest QCI image energy=    0.2900193908E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2900193908E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    523   -0.1000000000+201    0.1888565317E-02   -0.1000000000+201    0.6162652629E-01    0.1036558032E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6194108347     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18886E-02 d,cutoff=     2.8024         2.8733     max grad=    0.61624E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8822177859        0.1080051893E-01
 intlbfgs> Highest QCI image energy=    0.2900187920E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2900187920E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    524   -0.1000000000+201    0.1888638230E-02   -0.1000000000+201    0.6162396724E-01    0.1797648166E-05        15     3
 intlbfgs> Mean deviation     0.1080051893E-01 Decreasing QCI force constant to      1.055302599    
 intlbfgs> largest atomic distance between images is     0.6194277879     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18747E-02 d,cutoff=     2.8026         2.8733     max grad=    0.61118E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8822325808        0.1091670064E-01
 intlbfgs> Highest QCI image energy=    0.2872254540E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2872254540E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    525   -0.1000000000+201    0.1874736049E-02   -0.1000000000+201    0.6111796351E-01    0.2354725997E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6196113645     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17818E-02 d,cutoff=     2.8044         2.8733     max grad=    0.58101E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823309852        0.5075216165E-02
 intlbfgs> Highest QCI image energy=    0.2693911186E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2693911186E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    526   -0.1000000000+201    0.1781764912E-02   -0.1000000000+201    0.5810063514E-01    0.1627976262E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6194574072     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18627E-02 d,cutoff=     2.8029         2.8733     max grad=    0.60773E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8822446909        0.9670240933E-02
 intlbfgs> Highest QCI image energy=    0.2849591874E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2849591874E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    527   -0.1000000000+201    0.1862661191E-02   -0.1000000000+201    0.6077311408E-01    0.1406708413E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6194609778     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18624E-02 d,cutoff=     2.8029         2.8733     max grad=    0.60788E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8822447156        0.9338711419E-02
 intlbfgs> Highest QCI image energy=    0.2849543467E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2849543467E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    528   -0.1000000000+201    0.1862419668E-02   -0.1000000000+201    0.6078778913E-01    0.2417845711E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6194642814     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18621E-02 d,cutoff=     2.8029         2.8733     max grad=    0.60801E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8822447995        0.9015570724E-02
 intlbfgs> Highest QCI image energy=    0.2849387129E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2849387129E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    529   -0.1000000000+201    0.1862054467E-02   -0.1000000000+201    0.6080053769E-01    0.1900120398E-04        15     3
 intlbfgs> Mean deviation     0.9015570724E-02 Decreasing QCI force constant to      1.044854058    
 intlbfgs> largest atomic distance between images is     0.6194644690     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18621E-02 d,cutoff=     2.8029         2.8733     max grad=    0.60799E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8822448007        0.8983616988E-02
 intlbfgs> Highest QCI image energy=    0.2849385037E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2849385037E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    530   -0.1000000000+201    0.1862094007E-02   -0.1000000000+201    0.6079914385E-01    0.1554800193E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6222060976     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.24803E-02 d,cutoff=     2.7922         2.8733     max grad=    0.61453E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8825217700        0.4461584726    
 intlbfgs> Highest QCI image energy=    0.3081568679E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3081568679E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    531   -0.1000000000+201    0.2480309246E-02   -0.1000000000+201    0.6145311106E-01    0.2221911119E-01        15     3
 intlbfgs> largest atomic distance between images is     0.6194648994     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18621E-02 d,cutoff=     2.8029         2.8733     max grad=    0.60798E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8822448006        0.8916631582E-02
 intlbfgs> Highest QCI image energy=    0.2849385328E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2849385328E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    532   -0.1000000000+201    0.1862119762E-02   -0.1000000000+201    0.6079811608E-01    0.2221672449E-01        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6194648724     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18621E-02 d,cutoff=     2.8029         2.8733     max grad=    0.60798E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8822448013        0.8919112236E-02
 intlbfgs> Highest QCI image energy=    0.2849383985E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2849383985E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    533   -0.1000000000+201    0.1862118863E-02   -0.1000000000+201    0.6079804113E-01    0.1758588137E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6194601679     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18618E-02 d,cutoff=     2.8029         2.8733     max grad=    0.60789E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8822449679        0.9384310058E-02
 intlbfgs> Highest QCI image energy=    0.2849073954E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2849073954E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    534   -0.1000000000+201    0.1861805386E-02   -0.1000000000+201    0.6078897251E-01    0.2250974063E-04        15     3
 intlbfgs> Mean deviation     0.9384310058E-02 Decreasing QCI force constant to      1.034508968    
 intlbfgs> largest atomic distance between images is     0.6194785643     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18437E-02 d,cutoff=     2.8032         2.8733     max grad=    0.59918E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8822679492        0.1055802106E-01
 intlbfgs> Highest QCI image energy=    0.2806691168E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2806691168E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    535   -0.1000000000+201    0.1843682636E-02   -0.1000000000+201    0.5991803227E-01    0.3604376453E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6195069894     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18341E-02 d,cutoff=     2.8034         2.8733     max grad=    0.59828E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8822750000        0.8713343077E-02
 intlbfgs> Highest QCI image energy=    0.2793774720E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2793774720E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    536   -0.1000000000+201    0.1834113578E-02   -0.1000000000+201    0.5982765149E-01    0.1903167347E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6195187736     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18362E-02 d,cutoff=     2.8034         2.8733     max grad=    0.60064E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8822705516        0.6940995687E-02
 intlbfgs> Highest QCI image energy=    0.2801888437E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2801888437E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    537   -0.1000000000+201    0.1836188067E-02   -0.1000000000+201    0.6006400939E-01    0.9353221158E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6195166095     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18357E-02 d,cutoff=     2.8034         2.8733     max grad=    0.59981E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8822719908        0.7322934355E-02
 intlbfgs> Highest QCI image energy=    0.2799257238E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2799257238E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    538   -0.1000000000+201    0.1835718488E-02   -0.1000000000+201    0.5998147612E-01    0.3261667855E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6195175307     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18357E-02 d,cutoff=     2.8034         2.8733     max grad=    0.59980E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8822720107        0.7210622359E-02
 intlbfgs> Highest QCI image energy=    0.2799221013E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2799221013E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    539   -0.1000000000+201    0.1835728443E-02   -0.1000000000+201    0.5997963094E-01    0.2754552900E-05        15     3
 intlbfgs> Mean deviation     0.7210622359E-02 Decreasing QCI force constant to      1.024266305    
 intlbfgs> largest atomic distance between images is     0.6195199639     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18357E-02 d,cutoff=     2.8034         2.8733     max grad=    0.59980E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8822720199        0.6918173697E-02
 intlbfgs> Highest QCI image energy=    0.2799204471E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2799204471E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    540   -0.1000000000+201    0.1835699785E-02   -0.1000000000+201    0.5997950738E-01    0.6439316926E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6228117886     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17987E-02 d,cutoff=     2.8041         2.8733     max grad=    0.60125E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823147786        0.3884630954    
 intlbfgs> Highest QCI image energy=    0.2789208635E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2789208635E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    541   -0.1000000000+201    0.1798722145E-02   -0.1000000000+201    0.6012453196E-01    0.8693981426E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6195223674     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18358E-02 d,cutoff=     2.8034         2.8733     max grad=    0.59977E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8822720206        0.6627533238E-02
 intlbfgs> Highest QCI image energy=    0.2799203493E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2799203493E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    542   -0.1000000000+201    0.1835770687E-02   -0.1000000000+201    0.5997673190E-01    0.8687614279E-02        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6195222954     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18359E-02 d,cutoff=     2.8034         2.8733     max grad=    0.59972E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8822720249        0.6630097148E-02
 intlbfgs> Highest QCI image energy=    0.2799195749E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2799195749E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    543   -0.1000000000+201    0.1835916959E-02   -0.1000000000+201    0.5997150593E-01    0.2624771812E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6195224049     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18360E-02 d,cutoff=     2.8034         2.8733     max grad=    0.59968E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8822720318        0.6617465844E-02
 intlbfgs> Highest QCI image energy=    0.2799183176E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2799183176E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    544   -0.1000000000+201    0.1836000910E-02   -0.1000000000+201    0.5996848826E-01    0.1614744774E-05        15     3
 intlbfgs> Mean deviation     0.6617465844E-02 Decreasing QCI force constant to      1.014125055    
 intlbfgs> largest atomic distance between images is     0.6195297051     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18248E-02 d,cutoff=     2.8036         2.8733     max grad=    0.59549E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8822844958        0.7415596859E-02
 intlbfgs> Highest QCI image energy=    0.2776540751E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2776540751E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    545   -0.1000000000+201    0.1824821088E-02   -0.1000000000+201    0.5954924047E-01    0.1962738979E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6204742010     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.91860E-03 d,cutoff=     2.8236         2.8733     max grad=    0.36838E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8837054729        0.6939335941E-01
 intlbfgs> Highest QCI image energy=    0.1243774630E-02 images=       1
 intlbfgs> Highest image        2 energy     0.1243774630E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    546   -0.1000000000+201    0.9186024672E-03   -0.1000000000+201    0.3683816196E-01    0.1898763376E-01        15     3
 intlbfgs> largest atomic distance between images is     0.6195547331     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18129E-02 d,cutoff=     2.8038         2.8733     max grad=    0.59087E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8822983178        0.6483832325E-02
 intlbfgs> Highest QCI image energy=    0.2751674576E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2751674576E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    547   -0.1000000000+201    0.1812933949E-02   -0.1000000000+201    0.5908705224E-01    0.1877321043E-01        15     3
 intlbfgs> largest atomic distance between images is     0.6195614365     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18124E-02 d,cutoff=     2.8038         2.8733     max grad=    0.59121E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8822982004        0.5816974570E-02
 intlbfgs> Highest QCI image energy=    0.2751877234E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2751877234E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    548   -0.1000000000+201    0.1812385583E-02   -0.1000000000+201    0.5912065070E-01    0.2504569761E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6195811467     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18098E-02 d,cutoff=     2.8039         2.8733     max grad=    0.59167E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8822992606        0.4115394148E-02
 intlbfgs> Highest QCI image energy=    0.2749969539E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2749969539E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    549   -0.1000000000+201    0.1809751876E-02   -0.1000000000+201    0.5916742344E-01    0.8273597251E-04        15     3
 intlbfgs> Mean deviation     0.4115394148E-02 Decreasing QCI force constant to      1.004084213    
 intlbfgs> largest atomic distance between images is     0.6195781393     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18095E-02 d,cutoff=     2.8039         2.8733     max grad=    0.59163E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8822994646        0.4549977010E-02
 intlbfgs> Highest QCI image energy=    0.2749603926E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2749603926E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    550   -0.1000000000+201    0.1809501278E-02   -0.1000000000+201    0.5916306944E-01    0.1276547312E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6195468879     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18091E-02 d,cutoff=     2.8039         2.8733     max grad=    0.59179E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8822994168        0.8663069375E-02
 intlbfgs> Highest QCI image energy=    0.2749696701E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2749696701E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    551   -0.1000000000+201    0.1809076723E-02   -0.1000000000+201    0.5917894198E-01    0.1099421560E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6195781178     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18089E-02 d,cutoff=     2.8039         2.8733     max grad=    0.59170E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8822997314        0.4615770721E-02
 intlbfgs> Highest QCI image energy=    0.2749126489E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2749126489E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    552   -0.1000000000+201    0.1808863314E-02   -0.1000000000+201    0.5916965345E-01    0.1068219583E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6195845748     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18086E-02 d,cutoff=     2.8039         2.8733     max grad=    0.59154E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823001916        0.3851965963E-02
 intlbfgs> Highest QCI image energy=    0.2748304383E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2748304383E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    553   -0.1000000000+201    0.1808560634E-02   -0.1000000000+201    0.5915399917E-01    0.2128216911E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6196215224     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18035E-02 d,cutoff=     2.8040         2.8733     max grad=    0.59029E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823051467        0.5613686506E-04
 intlbfgs> Highest QCI image energy=    0.2739473621E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2739473621E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    554   -0.1000000000+201    0.1803519395E-02   -0.1000000000+201    0.5902912503E-01    0.1274978258E-03        15     3
 intlbfgs> Mean deviation     0.5613686506E-04 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6195769536     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17971E-02 d,cutoff=     2.8041         2.8733     max grad=    0.58583E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823153160        0.7030648087E-02
 intlbfgs> Highest QCI image energy=    0.2721411901E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2721411901E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    555   -0.1000000000+201    0.1797079007E-02   -0.1000000000+201    0.5858268657E-01    0.2389889186E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6196082860     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17889E-02 d,cutoff=     2.8043         2.8733     max grad=    0.58524E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823211422        0.4564550867E-02
 intlbfgs> Highest QCI image energy=    0.2711114845E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2711114845E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    556   -0.1000000000+201    0.1788918360E-02   -0.1000000000+201    0.5852362892E-01    0.1421393553E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6196169659     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17912E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58619E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823184963        0.3135136935E-02
 intlbfgs> Highest QCI image energy=    0.2715780653E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715780653E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    557   -0.1000000000+201    0.1791213968E-02   -0.1000000000+201    0.5861874334E-01    0.5404751953E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6196140800     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188524        0.3509648298E-02
 intlbfgs> Highest QCI image energy=    0.2715151859E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715151859E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    558   -0.1000000000+201    0.1791117762E-02   -0.1000000000+201    0.5859611361E-01    0.1191368767E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6196145846     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188664        0.3456650787E-02
 intlbfgs> Highest QCI image energy=    0.2715127148E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715127148E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    559   -0.1000000000+201    0.1791084089E-02   -0.1000000000+201    0.5859631155E-01    0.1064777562E-05        15     3
 intlbfgs> Mean deviation     0.3456650787E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196150727     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188672        0.3407608986E-02
 intlbfgs> Highest QCI image energy=    0.2715125755E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715125755E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    560   -0.1000000000+201    0.1791087159E-02   -0.1000000000+201    0.5859612014E-01    0.8010908201E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6196152871     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188662        0.3391153725E-02
 intlbfgs> Highest QCI image energy=    0.2715127464E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715127464E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    561   -0.1000000000+201    0.1791079460E-02   -0.1000000000+201    0.5859641643E-01    0.4676363417E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6196152772     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188660        0.3391688643E-02
 intlbfgs> Highest QCI image energy=    0.2715127870E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715127870E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    562   -0.1000000000+201    0.1791085525E-02   -0.1000000000+201    0.5859625945E-01    0.1164734383E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6196152700     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188656        0.3392305125E-02
 intlbfgs> Highest QCI image energy=    0.2715128515E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128515E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    563   -0.1000000000+201    0.1791085454E-02   -0.1000000000+201    0.5859628174E-01    0.1511797802E-07        15     3
 intlbfgs> largest atomic distance between images is     0.6196152690     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188656        0.3392386804E-02
 intlbfgs> Highest QCI image energy=    0.2715128600E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128600E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    564   -0.1000000000+201    0.1791085561E-02   -0.1000000000+201    0.5859627975E-01    0.4808789740E-08        15     3
 intlbfgs> Mean deviation     0.3392386804E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152692     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392360618E-02
 intlbfgs> Highest QCI image energy=    0.2715128800E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128800E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    565   -0.1000000000+201    0.1791085734E-02   -0.1000000000+201    0.5859628086E-01    0.2949027375E-08        15     3
 intlbfgs> largest atomic distance between images is     0.6196152694     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392347426E-02
 intlbfgs> Highest QCI image energy=    0.2715128727E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128727E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    566   -0.1000000000+201    0.1791085699E-02   -0.1000000000+201    0.5859627937E-01    0.6670361004E-09        15     3
 intlbfgs> largest atomic distance between images is     0.6196152694     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392346194E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    567   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627965E-01    0.1161326342E-09        15     3
 intlbfgs> largest atomic distance between images is     0.6196152694     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392343659E-02
 intlbfgs> Highest QCI image energy=    0.2715128734E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128734E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    568   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4612153102E-10        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340295E-02
 intlbfgs> Highest QCI image energy=    0.2715128734E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128734E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    569   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.6404314910E-10        15     3
 intlbfgs> Mean deviation     0.3392340295E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340290E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    570   -0.1000000000+201    0.1791085697E-02   -0.1000000000+201    0.5859627969E-01    0.8047632185E-11        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340272E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    571   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2614783727E-11        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340290E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    572   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2952641524E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340300E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    573   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2121042202E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340302E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    574   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5022994985E-13        15     3
 intlbfgs> Mean deviation     0.3392340302E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    575   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2290636660E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    576   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1964564522E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    577   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1698801511E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    578   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.7256818403E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    579   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1264294126E-14        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    580   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.8373498327E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    581   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2713357769E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340299E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    582   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.6348037414E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    583   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.6286298747E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    584   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1482750087E-14        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    585   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.9260264453E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    586   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2506661339E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    587   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1617901968E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    588   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1064867883E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    589   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4584669427E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    590   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.6867478405E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    591   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3492128226E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    592   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4837848857E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    593   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4263306245E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    594   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5076762769E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    595   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1331873417E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    596   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.7210907116E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    597   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5139728930E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    598   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4001385876E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    599   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1793042818E-13        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 checkrep> number of active repulsions and total=      56      56
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    600   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1735444626E-13        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    601   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.8652588974E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    602   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2943979312E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    603   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1664576922E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    604   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1067818439E-14        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    605   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2713573515E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    606   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1357555019E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    607   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.8129848792E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    608   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4330083244E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    609   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.6782650649E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    610   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3667367494E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    611   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2565360946E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    612   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1932296088E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    613   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.6123618540E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    614   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4330662272E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    615   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3797393404E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    616   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3384045626E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    617   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.6743728146E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    618   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3022740178E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    619   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.7666766860E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    620   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5890833435E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    621   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1754191006E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    622   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1269641570E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    623   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5081212595E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    624   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1143001344E-14        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    625   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5590900236E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    626   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2117801895E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    627   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1588994804E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    628   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3990733534E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    629   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1271475661E-14        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    630   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.7697630203E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    631   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5366816171E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    632   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2977949423E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    633   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.9257500956E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    634   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.9188885134E-13        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    635   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5888111043E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    636   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4603997096E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340300E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    637   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.8358571292E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    638   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.8310482476E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    639   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.6392624873E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    640   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3032245261E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    641   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2227210152E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    642   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2172041105E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    643   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4726537690E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    644   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2428125984E-14        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    645   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1909905005E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    646   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.9603909048E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    647   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4652359005E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    648   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1598900516E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    649   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1191092428E-14        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    650   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1093318700E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    651   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5591559082E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    652   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1443316597E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    653   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.8024940096E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    654   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3269197155E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    655   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2043983900E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    656   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1534226501E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    657   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1028778717E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    658   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4902051954E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    659   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2821413864E-14        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    660   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2124817011E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    661   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5389152505E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    662   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1140968345E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    663   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.6879210663E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    664   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3291856898E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    665   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5174579100E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    666   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4625380195E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    667   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.9082000373E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    668   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3916267201E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    669   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1674731155E-14        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    670   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1059296888E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    671   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3613681178E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    672   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1770597676E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    673   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1032137085E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    674   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5681180577E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    675   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.6169582488E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    676   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3825535173E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    677   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.6146563413E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    678   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3364414273E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340300E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    679   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3690297693E-13        15     3
 intlbfgs> Mean deviation     0.3392340300E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    680   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3628955863E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    681   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.8510577153E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    682   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4528606874E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    683   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.6286824127E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    684   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3122529021E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    685   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1400610990E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    686   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.7364568886E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    687   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3220644197E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    688   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1016180354E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    689   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1009971187E-12        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    690   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.8143580825E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    691   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3144077949E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    692   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2019157514E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    693   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1557230008E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    694   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.8489961259E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    695   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3846756052E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    696   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4749125547E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    697   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4689072854E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    698   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5505427657E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    699   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.9736244128E-14        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 checkrep> number of active repulsions and total=      56      56
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    700   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.9187934704E-14        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    701   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1091131677E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    702   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5927305938E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    703   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1229524286E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    704   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.6375464066E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    705   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.6554492882E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    706   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3749648806E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340300E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    707   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3074612758E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    708   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3019167278E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    709   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.7001932036E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    710   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3401294921E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    711   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2235644665E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    712   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1623404794E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    713   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.9300472999E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    714   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3981319058E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    715   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.8884583801E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    716   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5737984536E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    717   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1096804414E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    718   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5598313264E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    719   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1269914401E-14        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    720   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.7472654279E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    721   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3620430883E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    722   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1962450203E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    723   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1534543781E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    724   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.8493005553E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    725   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3820456480E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    726   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1810076893E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    727   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1296801650E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    728   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.9102373886E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    729   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4215489783E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    730   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.7570848257E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    731   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4020505330E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    732   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1021278818E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    733   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.9601689066E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    734   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.7204028422E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    735   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2377132675E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    736   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1061249536E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    737   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5885454755E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    738   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1066465495E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    739   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5791186391E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    740   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2503422887E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    741   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1950575258E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    742   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5288498339E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    743   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.9437770152E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    744   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5028877419E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    745   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1654190185E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    746   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.9110360453E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    747   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3855536107E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340298E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    748   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3371508944E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    749   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3366108193E-12        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    750   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.6213699164E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    751   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2345772196E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    752   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1789706895E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    753   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.8568973024E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    754   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3912736094E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    755   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2653811184E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    756   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2008675645E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    757   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4849794582E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    758   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1894765499E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    759   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1836179755E-13        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    760   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.7322889320E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    761   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3422397673E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    762   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2229539123E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    763   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1705044645E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    764   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.7100138726E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    765   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3306101078E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    766   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.9634910617E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    767   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.9574468389E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    768   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.7114461904E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    769   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3107823284E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    770   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1564009706E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    771   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1072750855E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    772   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.6355816547E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    773   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3445456129E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340302E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    774   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.6467904041E-12        15     3
 intlbfgs> Mean deviation     0.3392340302E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    775   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.6462111656E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    776   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.8456715693E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    777   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3630820240E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    778   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1511156668E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    779   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.8739984495E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    780   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3514138438E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340300E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    781   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5086681273E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    782   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5028925499E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    783   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.8996334558E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    784   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5226099854E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    785   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.6360346793E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    786   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3189936645E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    787   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2995621689E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    788   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2477579327E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    789   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.7442002103E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    790   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3489097065E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    791   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.6188159224E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    792   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5590444299E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    793   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5816393949E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    794   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1231838311E-14        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    795   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5554119243E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    796   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2058620032E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    797   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1572000769E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    798   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.8400746361E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    799   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3971355130E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 checkrep> number of active repulsions and total=      56      56
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    800   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1159636667E-14        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    801   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.6666439771E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    802   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2455944594E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    803   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.7794036888E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    804   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.7167042065E-14        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    805   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.7113239396E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    806   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5545205621E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    807   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1419351507E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    808   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1356501955E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    809   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.8314472219E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    810   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3802479020E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    811   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2867825986E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    812   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2276998161E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    813   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4758936865E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    814   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1047280103E-14        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    815   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5238275594E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    816   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1384427522E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    817   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.8196153844E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    818   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5389336554E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    819   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.8627099787E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    820   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4787529791E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    821   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1208471838E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    822   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5974210002E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    823   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1929797065E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    824   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1462853570E-14        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    825   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.7566111045E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    826   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3818140597E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    827   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1198564909E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    828   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.6000028048E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    829   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1214311169E-14        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    830   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.6962483315E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    831   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4614241816E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    832   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5926767166E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    833   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3144494328E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    834   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1967545835E-14        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    835   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1253626885E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    836   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4330607105E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340302E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    837   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1520202883E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    838   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1514425149E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    839   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.6703667688E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    840   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3272837642E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    841   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2596312664E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    842   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2077075167E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    843   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.8995444434E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    844   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4213268529E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    845   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4837518440E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    846   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4225353130E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    847   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.6619770722E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    848   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.6626033955E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    849   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3077396022E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    850   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1109796712E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    851   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.6116242867E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    852   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3892022508E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    853   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3216019175E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    854   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.6216742469E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    855   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5989785751E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    856   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2538463604E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    857   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.9226331754E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    858   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.8671100054E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    859   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.8118994876E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    860   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4715290045E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    861   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1690330267E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    862   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1355299028E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    863   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.9852116552E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    864   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4799105268E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    865   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1664256439E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    866   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.8622983099E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    867   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5091423271E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    868   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2347030067E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    869   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1749904016E-14        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    870   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4299918913E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340303E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    871   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2282629139E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    872   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2276626594E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    873   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.8215985928E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    874   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3647862971E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    875   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1912180487E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    876   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1444276754E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    877   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.7705174429E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    878   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3462203654E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    879   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1165038360E-13        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    880   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1107700170E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    881   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.9524567781E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    882   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4302034068E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    883   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1488627837E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    884   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.7997213283E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    885   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3380991278E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    886   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1572915364E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    887   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1566649913E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    888   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1080038229E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    889   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.6040231296E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    890   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.6631701107E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    891   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3628050822E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    892   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5024539476E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    893   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4392954167E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    894   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.7644358401E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    895   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4174410029E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    896   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.9703032161E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    897   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.9650519158E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    898   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.8442127331E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    899   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4031841782E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 checkrep> number of active repulsions and total=      56      56
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    900   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.6528793821E-14        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    901   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5863218159E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    902   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.6745862392E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    903   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.6036657774E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    904   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3625361426E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    905   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1928374502E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    906   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1862200487E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    907   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5297435877E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    908   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.7890127013E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    909   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3951909715E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    910   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1330627892E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    911   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.8173515469E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    912   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3529149112E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    913   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3216587120E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    914   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2637409441E-14        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    915   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.6222179255E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    916   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4116152085E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    917   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.8402944678E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    918   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4180312633E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    919   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2969332944E-14        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    920   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2396425962E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    921   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4764374712E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    922   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.7789809805E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    923   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.7255459281E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    924   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.8449986767E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    925   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3287487839E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    926   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1325633074E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    927   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.7561883447E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    928   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3609682962E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    929   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1334862263E-14        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    930   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.7084898270E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    931   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1170470633E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    932   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.6724217730E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    933   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1963998817E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    934   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1527131651E-14        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    935   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5859538612E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    936   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3072695359E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340300E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    937   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1942429148E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    938   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1936414003E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    939   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.7901459156E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    940   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3856543642E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    941   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.9803717208E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    942   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4535031711E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    943   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3169856886E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    944   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2695822737E-14        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    945   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.7721226844E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    946   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3501375330E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    947   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1596415735E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    948   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.8921851386E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    949   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4011409132E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    950   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.6118767541E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    951   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3141934137E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    952   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.9156394021E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    953   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.8567371195E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    954   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5489314335E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    955   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2095991404E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    956   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1598489973E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    957   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.9249246075E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    958   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3968407686E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    959   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.9111870527E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    960   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5010368351E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    961   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5079977703E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    962   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4461527102E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    963   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5710564935E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340300E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    964   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5285311523E-13        15     3
 intlbfgs> Mean deviation     0.3392340300E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    965   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5225169103E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    966   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.6933052826E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    967   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2792299952E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    968   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1867514164E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    969   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1443165827E-14        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    970   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.8621037259E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    971   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3825359732E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    972   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3219513720E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    973   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2717377729E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    974   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.8533417376E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    975   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3889629433E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    976   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1422975815E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    977   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.7717340028E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    978   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4651269988E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    979   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4988798452E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    980   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3770759445E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    981   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3712135787E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    982   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5552586682E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340300E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    983   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2649104411E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    984   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2589046508E-13        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    985   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.8366061228E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    986   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4436575293E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    987   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.8027093218E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    988   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4516765746E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    989   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3188802248E-13        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    990   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3130301989E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    991   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.6389668191E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    992   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.8510719250E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    993   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4809733710E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    994   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2470068730E-14        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    995   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1898874393E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    996   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4693499431E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    997   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2622386598E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    998   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2025654581E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:    999   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4631081559E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 checkrep> number of active repulsions and total=      56      56
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1000   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.7039969603E-15        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1001   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3764290007E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1002   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1116821893E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1003   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.5952476089E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1004   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4249096464E-15        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1005   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3101470569E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1006   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2640987473E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1007   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.9716545768E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1008   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3856709484E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1009   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1511358519E-14        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1010   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.8612762765E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1011   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.3370922105E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1012   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.8951830539E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1013   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.4384441640E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1014   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.2018054540E-14        15     3
 intlbfgs> Mean deviation     0.3392340301E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.2715128733E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2715128733E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1015   -0.1000000000+201    0.1791085698E-02   -0.1000000000+201    0.5859627969E-01    0.1512204673E-14        15     3
 intlbfgs> Allowing   1000 further optimization steps
 intlbfgs> extra distance before turning on constraint potential is now     0.050000
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.74224E-01 d,ref,cutoff=     1.5598         1.6201        0.51284E-01 max grad=     16.500    
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.9067917817E-01 images=       1
 intlbfgs> Highest image        2 energy     0.9067917817E-01 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1016    0.7422426812E-01    0.1791085698E-02     16.50034231        0.5859627969E-01    0.6642824018E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6196152695     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.74224E-01 d,ref,cutoff=     1.5598         1.6201        0.51284E-01 max grad=     16.500    
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17911E-02 d,cutoff=     2.8042         2.8733     max grad=    0.58596E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823188655        0.3392340301E-02
 intlbfgs> Highest QCI image energy=    0.9067917817E-01 images=       1
 intlbfgs> Highest image        2 energy     0.9067917817E-01 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1017    0.7422426812E-01    0.1791085698E-02     16.50034231        0.5859627969E-01    0.7510029078E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6448142590     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     32 atoms      6     8 value=    0.13996     d,ref,cutoff=     4.7439         4.8128        0.55728E-01 max grad=     22.920    
 congrad> Highest repulsion  for image      2 ind     50 atoms      8    10 value=    0.75055E-02 d,cutoff=     2.4056         2.5279     max grad=    0.16072    
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8929155635         1.183362060    
 intlbfgs> Highest QCI image energy=    0.2742504429     images=       1
 intlbfgs> Highest image        2 energy     0.2742504429     is      0.000000000     sigma from the mean
 intlbfgs> steps:   1018    0.1399613969        0.7505478067E-02     22.92011081        0.1607231808        0.1300983397            15     3
 intlbfgs> largest atomic distance between images is     0.6206310038     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.72620E-01 d,ref,cutoff=     1.5599         1.6201        0.51284E-01 max grad=     16.298    
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17795E-02 d,cutoff=     2.8044         2.8733     max grad=    0.51763E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8825568646        0.1117336270    
 intlbfgs> Highest QCI image energy=    0.8985755011E-01 images=       1
 intlbfgs> Highest image        2 energy     0.8985755011E-01 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1019    0.7262029322E-01    0.1779527952E-02     16.29776195        0.5176284624E-01    0.1301142809            15     3
 intlbfgs> Mean deviation     0.1117336270     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6207552977     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.78152E-01 d,ref,cutoff=     1.5596         1.6201        0.51284E-01 max grad=     16.992    
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17691E-02 d,cutoff=     2.8046         2.8733     max grad=    0.51607E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8825543408        0.1128464063    
 intlbfgs> Highest QCI image energy=    0.9022872431E-01 images=       1
 intlbfgs> Highest image        2 energy     0.9022872431E-01 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1020    0.7815211088E-01    0.1769070705E-02     16.99200560        0.5160652442E-01    0.1209949142E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6204041020     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     40 atoms      7    10 value=    0.11322E-02 d,ref,cutoff=     3.2997         3.3911        0.89355E-01 max grad=    0.72713    
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18902E-02 d,cutoff=     2.8024         2.8733     max grad=    0.53423E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8825925406        0.1244890328    
 intlbfgs> Highest QCI image energy=    0.3621137449E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3621137449E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1021    0.1132225281E-02    0.1890200275E-02    0.7271295401        0.5342250539E-01    0.1064725520E-01        15     3
 intlbfgs> largest atomic distance between images is     0.6204134672     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     40 atoms      7    10 value=    0.46979E-03 d,ref,cutoff=     3.3004         3.3911        0.89355E-01 max grad=    0.46458    
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19011E-02 d,cutoff=     2.8022         2.8733     max grad=    0.53580E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8825986600        0.1223317884    
 intlbfgs> Highest QCI image energy=    0.2951855093E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2951855093E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1022    0.4697935987E-03    0.1901078767E-02    0.4645781591        0.5358021715E-01    0.5254203988E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6204366528     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     40 atoms      7    10 value=    0.94021E-06 d,ref,cutoff=     3.3017         3.3911        0.89355E-01 max grad=    0.20486E-01
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19198E-02 d,cutoff=     2.8018         2.8733     max grad=    0.53851E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8826076239        0.1185887703    
 intlbfgs> Highest QCI image energy=    0.2473847060E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2473847060E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1023    0.9402092374E-06    0.1919811915E-02    0.2048581913E-01    0.5385085453E-01    0.9232879836E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6204415547     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     40 atoms      7    10 value=    0.45727E-07 d,ref,cutoff=     3.3017         3.3911        0.89355E-01 max grad=    0.45154E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19204E-02 d,cutoff=     2.8018         2.8733     max grad=    0.53860E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8826053364        0.1183733620    
 intlbfgs> Highest QCI image energy=    0.2474690487E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2474690487E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1024    0.4572706717E-07    0.1920440211E-02    0.4515359524E-02    0.5385998195E-01    0.7929290518E-04        15     3
 intlbfgs> Mean deviation     0.1183733620     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6204609925     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19220E-02 d,cutoff=     2.8018         2.8733     max grad=    0.53883E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8825921777        0.1176003485    
 intlbfgs> Highest QCI image energy=    0.2485256058E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2485256058E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1025   -0.1000000000+201    0.1922010063E-02   -0.1000000000+201    0.5388299617E-01    0.3579812761E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6206450133     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19366E-02 d,cutoff=     2.8015         2.8733     max grad=    0.54097E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8824473462        0.1079267471    
 intlbfgs> Highest QCI image energy=    0.2626089977E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2626089977E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1026   -0.1000000000+201    0.1936617124E-02   -0.1000000000+201    0.5409699131E-01    0.3995384362E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6205598473     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.44980E-02 d,ref,cutoff=     1.5665         1.6201        0.51284E-01 max grad=     3.6102    
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18721E-02 d,cutoff=     2.8027         2.8733     max grad=    0.57443E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823215809        0.6043283512E-01
 intlbfgs> Highest QCI image energy=    0.7250343641E-02 images=       1
 intlbfgs> Highest image        2 energy     0.7250343641E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1027    0.4498034463E-02    0.1872052169E-02     3.610183258        0.5744254392E-01    0.6461794866E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6207920696     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19570E-02 d,cutoff=     2.8011         2.8733     max grad=    0.54393E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823745675        0.1080373294    
 intlbfgs> Highest QCI image energy=    0.2728513965E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2728513965E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1028   -0.1000000000+201    0.1957001112E-02   -0.1000000000+201    0.5439335759E-01    0.5087210672E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6208600133     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19662E-02 d,cutoff=     2.8010         2.8733     max grad=    0.55390E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823420021        0.1079207685    
 intlbfgs> Highest QCI image energy=    0.2779818952E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2779818952E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1029   -0.1000000000+201    0.1966180406E-02   -0.1000000000+201    0.5539046974E-01    0.9726126273E-03        15     3
 intlbfgs> Mean deviation     0.1079207685     Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6204582379     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18717E-02 d,cutoff=     2.8027         2.8733     max grad=    0.58513E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823242323        0.6927031031E-01
 intlbfgs> Highest QCI image energy=    0.2786242534E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2786242534E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1030   -0.1000000000+201    0.1871702878E-02   -0.1000000000+201    0.5851294171E-01    0.2563416195E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6198588884     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     40 atoms      7    10 value=    0.67014E-03 d,ref,cutoff=     3.3001         3.3911        0.89355E-01 max grad=     1.0581    
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18288E-02 d,cutoff=     2.8035         2.8733     max grad=    0.59018E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823300770        0.1678733519E-01
 intlbfgs> Highest QCI image energy=    0.3830855712E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3830855712E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1031    0.6701420214E-03    0.1828777550E-02     1.058115867        0.5901840519E-01    0.2535123930E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6204378505     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18805E-02 d,cutoff=     2.8025         2.8733     max grad=    0.58942E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823132877        0.6527149790E-01
 intlbfgs> Highest QCI image energy=    0.2804798298E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2804798298E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1032   -0.1000000000+201    0.1880476806E-02   -0.1000000000+201    0.5894192383E-01    0.2446493895E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6204222982     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18850E-02 d,cutoff=     2.8025         2.8733     max grad=    0.58891E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823118076        0.6359816016E-01
 intlbfgs> Highest QCI image energy=    0.2807002077E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2807002077E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1033   -0.1000000000+201    0.1884989901E-02   -0.1000000000+201    0.5889070092E-01    0.1055941037E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6201160517     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.22479E-02 d,ref,cutoff=     1.5672         1.6201        0.51284E-01 max grad=     2.5194    
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18686E-02 d,cutoff=     2.8028         2.8733     max grad=    0.56885E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823283412        0.2814840455E-01
 intlbfgs> Highest QCI image energy=    0.4984281913E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4984281913E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1034    0.2247869375E-02    0.1868602175E-02     2.519388131        0.5688516108E-01    0.3369077556E-02        15     3
 intlbfgs> Mean deviation     0.2814840455E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6203826995     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18957E-02 d,cutoff=     2.8023         2.8733     max grad=    0.58776E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823083985        0.5942689728E-01
 intlbfgs> Highest QCI image energy=    0.2812576471E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2812576471E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1035   -0.1000000000+201    0.1895720011E-02   -0.1000000000+201    0.5877614802E-01    0.3312981930E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6203752998     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18959E-02 d,cutoff=     2.8023         2.8733     max grad=    0.58755E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823084761        0.5869584634E-01
 intlbfgs> Highest QCI image energy=    0.2812130085E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2812130085E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1036   -0.1000000000+201    0.1895861438E-02   -0.1000000000+201    0.5875536461E-01    0.2849150593E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6190741047     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     49 atoms     14    15 value=    0.41052E-02 d,ref,cutoff=     1.5657         1.6211        0.53052E-01 max grad=     3.5203    
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18426E-02 d,cutoff=     2.8032         2.8733     max grad=    0.58600E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823096288        0.5851119367E-01
 intlbfgs> Highest QCI image energy=    0.1051374633E-01 images=       1
 intlbfgs> Highest image        2 energy     0.1051374633E-01 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1037    0.4105206725E-02    0.1842587270E-02     3.520289363        0.5859981899E-01    0.5166445418E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6203321229     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19009E-02 d,cutoff=     2.8022         2.8733     max grad=    0.58437E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823105560        0.5378513373E-01
 intlbfgs> Highest QCI image energy=    0.2807747366E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2807747366E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1038   -0.1000000000+201    0.1900911400E-02   -0.1000000000+201    0.5843678576E-01    0.5050697590E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6203030711     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19040E-02 d,cutoff=     2.8021         2.8733     max grad=    0.58233E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823119260        0.5051056551E-01
 intlbfgs> Highest QCI image energy=    0.2804892303E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2804892303E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1039   -0.1000000000+201    0.1904018106E-02   -0.1000000000+201    0.5823263700E-01    0.1399075787E-03        15     3
 intlbfgs> Mean deviation     0.5051056551E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6198458367     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     40 atoms      7    10 value=    0.80300E-06 d,ref,cutoff=     3.3017         3.3911        0.89355E-01 max grad=    0.18907E-01
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18644E-02 d,cutoff=     2.8028         2.8733     max grad=    0.57262E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823343812        0.3958978840E-02
 intlbfgs> Highest QCI image energy=    0.2748722205E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2748722205E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1040    0.8029973173E-06    0.1864442207E-02    0.1890724504E-01    0.5726224053E-01    0.2342250796E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6187106486     for atom     10 and images      2     3 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.12670E-01 d,ref,cutoff=     1.5649         1.6201        0.51284E-01 max grad=     6.2306    
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18509E-02 d,cutoff=     2.8031         2.8733     max grad=    0.52838E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8824249308        0.1258845518    
 intlbfgs> Highest QCI image energy=    0.1527790631E-01 images=       1
 intlbfgs> Highest image        2 energy     0.1527790631E-01 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1041    0.1267018261E-01    0.1850905667E-02     6.230623267        0.5283832662E-01    0.5486117847E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6197767628     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18943E-02 d,cutoff=     2.8023         2.8733     max grad=    0.55948E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823416708        0.6523655377E-02
 intlbfgs> Highest QCI image energy=    0.2739085663E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2739085663E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1042   -0.1000000000+201    0.1894288119E-02   -0.1000000000+201    0.5594764014E-01    0.5286965968E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6198453326     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18780E-02 d,cutoff=     2.8026         2.8733     max grad=    0.56663E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823377043        0.1767065974E-02
 intlbfgs> Highest QCI image energy=    0.2743453328E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743453328E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1043   -0.1000000000+201    0.1878021147E-02   -0.1000000000+201    0.5666344328E-01    0.4844948409E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6201408414     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     49 atoms     14    15 value=    0.74493E-04 d,ref,cutoff=     1.5677         1.6211        0.53052E-01 max grad=    0.45679    
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18642E-02 d,cutoff=     2.8028         2.8733     max grad=    0.58759E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823084794        0.3749173030E-01
 intlbfgs> Highest QCI image energy=    0.2885866119E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2885866119E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1044    0.7449280521E-04    0.1864195851E-02    0.4567874499        0.5875868413E-01    0.2242922009E-02        15     3
 intlbfgs> Mean deviation     0.3749173030E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6199972143     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     40 atoms      7    10 value=    0.56830E-05 d,ref,cutoff=     3.3016         3.3911        0.89355E-01 max grad=    0.50357E-01
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18445E-02 d,cutoff=     2.8032         2.8733     max grad=    0.58224E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823288365        0.2017301078E-01
 intlbfgs> Highest QCI image energy=    0.2762305718E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2762305718E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1045    0.5682974645E-05    0.1844454988E-02    0.5035717160E-01    0.5822395943E-01    0.2104781820E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6187458914     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.21290E-02 d,cutoff=     2.7981         2.8733     max grad=    0.56803E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8824428060        0.1357688764    
 intlbfgs> Highest QCI image energy=    0.2717874755E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2717874755E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1046   -0.1000000000+201    0.2128996498E-02   -0.1000000000+201    0.5680341264E-01    0.8384955238E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6196928418     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.14600E-04 d,ref,cutoff=     1.5687         1.6201        0.51284E-01 max grad=    0.19707    
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.19316E-02 d,cutoff=     2.8016         2.8733     max grad=    0.54020E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823711538        0.2762460554E-01
 intlbfgs> Highest QCI image energy=    0.2717797323E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2717797323E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1047    0.1459999872E-04    0.1931641586E-02    0.1970687622        0.5402038731E-01    0.5974449167E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6201990666     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18357E-02 d,cutoff=     2.8034         2.8733     max grad=    0.57872E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823421824        0.3258842937E-01
 intlbfgs> Highest QCI image energy=    0.2741958384E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2741958384E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1048   -0.1000000000+201    0.1835722516E-02   -0.1000000000+201    0.5787210242E-01    0.3198627732E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6200972627     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18547E-02 d,cutoff=     2.8030         2.8733     max grad=    0.57037E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823454388        0.2122228470E-01
 intlbfgs> Highest QCI image energy=    0.2735066660E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2735066660E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1049   -0.1000000000+201    0.1854697593E-02   -0.1000000000+201    0.5703718165E-01    0.6194412382E-03        15     3
 intlbfgs> Mean deviation     0.2122228470E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6199363496     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18554E-02 d,cutoff=     2.8030         2.8733     max grad=    0.58094E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823246173        0.1186919329E-01
 intlbfgs> Highest QCI image energy=    0.2761822614E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2761822614E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1050   -0.1000000000+201    0.1855449585E-02   -0.1000000000+201    0.5809447061E-01    0.1529212363E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6196166736     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     49 atoms     14    15 value=    0.34830E-02 d,ref,cutoff=     1.5658         1.6211        0.53052E-01 max grad=     3.2315    
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18045E-02 d,cutoff=     2.8040         2.8733     max grad=    0.56760E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823657306        0.8483887977E-02
 intlbfgs> Highest QCI image energy=    0.7132063719E-02 images=       1
 intlbfgs> Highest image        2 energy     0.7132063719E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1051    0.3482967696E-02    0.1804523444E-02     3.231476612        0.5675992827E-01    0.3112906651E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6199271213     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18445E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57307E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823410650        0.1064396739E-01
 intlbfgs> Highest QCI image energy=    0.2732062107E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2732062107E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1052   -0.1000000000+201    0.1844537971E-02   -0.1000000000+201    0.5730662237E-01    0.2999680735E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6199252225     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18414E-02 d,cutoff=     2.8033         2.8733     max grad=    0.57110E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823453187        0.1041092038E-01
 intlbfgs> Highest QCI image energy=    0.2724407817E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2724407817E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1053   -0.1000000000+201    0.1841444224E-02   -0.1000000000+201    0.5711031921E-01    0.8626426985E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6198929297     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.29217E-02 d,ref,cutoff=     1.5669         1.6201        0.51284E-01 max grad=     2.8849    
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18144E-02 d,cutoff=     2.8038         2.8733     max grad=    0.57426E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823415700        0.1012398030E-01
 intlbfgs> Highest QCI image energy=    0.5631358661E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5631358661E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1054    0.2921739462E-02    0.1814405663E-02     2.884921075        0.5742581562E-01    0.1958865161E-02        15     3
 intlbfgs> Mean deviation     0.1012398030E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6199264922     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18450E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57367E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823397976        0.1066482297E-01
 intlbfgs> Highest QCI image energy=    0.2733992491E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2733992491E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1055   -0.1000000000+201    0.1844974301E-02   -0.1000000000+201    0.5736731648E-01    0.1966267944E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6199257167     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18449E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57380E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823395644        0.1063454076E-01
 intlbfgs> Highest QCI image energy=    0.2734286913E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2734286913E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1056   -0.1000000000+201    0.1844941034E-02   -0.1000000000+201    0.5737984473E-01    0.8887442462E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6194044970     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.20024E-01 d,ref,cutoff=     1.5639         1.6201        0.51284E-01 max grad=     7.9760    
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18199E-02 d,cutoff=     2.8037         2.8733     max grad=    0.60631E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8822798950        0.1483157749E-01
 intlbfgs> Highest QCI image energy=    0.3001602825E-01 images=       1
 intlbfgs> Highest image        2 energy     0.3001602825E-01 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1057    0.2002412392E-01    0.1819855597E-02     7.976033438        0.6063093525E-01    0.5526619750E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6199248441     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18450E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57538E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823370863        0.1073785065E-01
 intlbfgs> Highest QCI image energy=    0.2738481991E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2738481991E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1058   -0.1000000000+201    0.1844989797E-02   -0.1000000000+201    0.5753787309E-01    0.5512254921E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6199240005     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18450E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57666E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823350780        0.1081356068E-01
 intlbfgs> Highest QCI image energy=    0.2741879774E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2741879774E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1059   -0.1000000000+201    0.1845022770E-02   -0.1000000000+201    0.5766574448E-01    0.4295451155E-04        15     3
 intlbfgs> Mean deviation     0.1081356068E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6198465933     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     40 atoms      7    10 value=    0.22646E-05 d,ref,cutoff=     3.3017         3.3911        0.89355E-01 max grad=    0.31766E-01
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18437E-02 d,cutoff=     2.8032         2.8733     max grad=    0.58972E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823147811        0.7002940924E-02
 intlbfgs> Highest QCI image energy=    0.2777967459E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2777967459E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1060    0.2264575323E-05    0.1843722134E-02    0.3176647915E-01    0.5897182450E-01    0.6988252875E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6199161060     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18455E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57891E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823312519        0.1038835325E-01
 intlbfgs> Highest QCI image energy=    0.2748235613E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2748235613E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1061   -0.1000000000+201    0.1845512109E-02   -0.1000000000+201    0.5789139109E-01    0.6181442754E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6199081202     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18458E-02 d,cutoff=     2.8032         2.8733     max grad=    0.58013E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823291383        0.9881176791E-02
 intlbfgs> Highest QCI image energy=    0.2751675428E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2751675428E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1062   -0.1000000000+201    0.1845800109E-02   -0.1000000000+201    0.5801255269E-01    0.6396430395E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6197020805     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.85280E-02 d,ref,cutoff=     1.5656         1.6201        0.51284E-01 max grad=     5.0515    
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18110E-02 d,cutoff=     2.8038         2.8733     max grad=    0.59441E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823072768        0.2968193866E-02
 intlbfgs> Highest QCI image energy=    0.1154942214E-01 images=       1
 intlbfgs> Highest image        2 energy     0.1154942214E-01 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1063    0.8527968052E-02    0.1811044626E-02     5.051467688        0.5944114961E-01    0.2907054897E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6199183847     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18446E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57829E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823323811        0.1056811869E-01
 intlbfgs> Highest QCI image energy=    0.2745805086E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2745805086E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1064   -0.1000000000+201    0.1844631611E-02   -0.1000000000+201    0.5782889266E-01    0.2920662744E-02        15     3
 intlbfgs> Mean deviation     0.1056811869E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6199198603     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18442E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57796E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823330067        0.1069400108E-01
 intlbfgs> Highest QCI image energy=    0.2744583039E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2744583039E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1065   -0.1000000000+201    0.1844213915E-02   -0.1000000000+201    0.5779623364E-01    0.2044683506E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6199119054     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     49 atoms     14    15 value=    0.22702E-02 d,ref,cutoff=     1.5663         1.6211        0.53052E-01 max grad=     2.5896    
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18118E-02 d,cutoff=     2.8038         2.8733     max grad=    0.56573E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823599836        0.1579334186E-01
 intlbfgs> Highest QCI image energy=    0.5146402327E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5146402327E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1066    0.2270208244E-02    0.1811794364E-02     2.589572961        0.5657326390E-01    0.2129421947E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6198891666     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18466E-02 d,cutoff=     2.8032         2.8733     max grad=    0.58221E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823250740        0.9098534134E-02
 intlbfgs> Highest QCI image energy=    0.2757926023E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2757926023E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1067   -0.1000000000+201    0.1846594264E-02   -0.1000000000+201    0.5822053359E-01    0.2114366898E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6198673997     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18482E-02 d,cutoff=     2.8031         2.8733     max grad=    0.58518E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823195383        0.7968618816E-02
 intlbfgs> Highest QCI image energy=    0.2767312983E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2767312983E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1068   -0.1000000000+201    0.1848220792E-02   -0.1000000000+201    0.5851826055E-01    0.1401452277E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6196832946     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.26382E-02 d,ref,cutoff=     1.5670         1.6201        0.51284E-01 max grad=     2.7364    
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18273E-02 d,cutoff=     2.8035         2.8733     max grad=    0.58959E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823117728        0.2359932886E-02
 intlbfgs> Highest QCI image energy=    0.5876630937E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5876630937E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1069    0.2638157440E-02    0.1827254933E-02     2.736363391        0.5895944648E-01    0.2215820817E-02        15     3
 intlbfgs> Mean deviation     0.2359932886E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6198721113     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18476E-02 d,cutoff=     2.8032         2.8733     max grad=    0.58434E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823210859        0.8211261785E-02
 intlbfgs> Highest QCI image energy=    0.2764484535E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2764484535E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1070   -0.1000000000+201    0.1847570141E-02   -0.1000000000+201    0.5843405229E-01    0.2218617055E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6198718573     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18474E-02 d,cutoff=     2.8032         2.8733     max grad=    0.58426E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823212375        0.8198848399E-02
 intlbfgs> Highest QCI image energy=    0.2764124257E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2764124257E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1071   -0.1000000000+201    0.1847419684E-02   -0.1000000000+201    0.5842550895E-01    0.7518034736E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6196541407     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.25102E-01 d,ref,cutoff=     1.5634         1.6201        0.51284E-01 max grad=     9.0189    
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17864E-02 d,cutoff=     2.8043         2.8733     max grad=    0.55746E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823675997        0.3087338508E-03
 intlbfgs> Highest QCI image energy=    0.3205764146E-01 images=       1
 intlbfgs> Highest image        2 energy     0.3205764146E-01 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1072    0.2510235901E-01    0.1786361429E-02     9.018875500        0.5574573701E-01    0.5101068351E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6198718969     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18455E-02 d,cutoff=     2.8032         2.8733     max grad=    0.58293E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823240713        0.8136083169E-02
 intlbfgs> Highest QCI image energy=    0.2758949294E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2758949294E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1073   -0.1000000000+201    0.1845499521E-02   -0.1000000000+201    0.5829317385E-01    0.5075329710E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6198718508     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18440E-02 d,cutoff=     2.8032         2.8733     max grad=    0.58188E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823263216        0.8083012248E-02
 intlbfgs> Highest QCI image energy=    0.2754841670E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2754841670E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1074   -0.1000000000+201    0.1843966480E-02   -0.1000000000+201    0.5818807194E-01    0.5154282568E-04        15     3
 intlbfgs> Mean deviation     0.8083012248E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6198225956     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     40 atoms      7    10 value=    0.84384E-04 d,ref,cutoff=     3.3012         3.3911        0.89355E-01 max grad=    0.19497    
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18279E-02 d,cutoff=     2.8035         2.8733     max grad=    0.57687E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823400602        0.6211506237E-02
 intlbfgs> Highest QCI image energy=    0.2813042680E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2813042680E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1075    0.8438435009E-04    0.1827891169E-02    0.1949734696        0.5768695427E-01    0.7769481092E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6198754256     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18381E-02 d,cutoff=     2.8033         2.8733     max grad=    0.57721E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823360246        0.7945201588E-02
 intlbfgs> Highest QCI image energy=    0.2737409576E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2737409576E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1076   -0.1000000000+201    0.1838065942E-02   -0.1000000000+201    0.5772128857E-01    0.6636247319E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6198758619     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18363E-02 d,cutoff=     2.8034         2.8733     max grad=    0.57581E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823389284        0.7869735503E-02
 intlbfgs> Highest QCI image energy=    0.2732188131E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2732188131E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1077   -0.1000000000+201    0.1836287155E-02   -0.1000000000+201    0.5758062227E-01    0.6163586507E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6198583764     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.46631E-02 d,ref,cutoff=     1.5664         1.6201        0.51284E-01 max grad=     3.6790    
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18150E-02 d,cutoff=     2.8038         2.8733     max grad=    0.57304E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823409633        0.6394755628E-02
 intlbfgs> Highest QCI image energy=    0.7552892475E-02 images=       1
 intlbfgs> Highest image        2 energy     0.7552892475E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1078    0.4663134062E-02    0.1814993737E-02     3.678967193        0.5730351905E-01    0.2036520617E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6198736250     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18411E-02 d,cutoff=     2.8033         2.8733     max grad=    0.57995E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823303104        0.8043317385E-02
 intlbfgs> Highest QCI image energy=    0.2747201745E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2747201745E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1079   -0.1000000000+201    0.1841108034E-02   -0.1000000000+201    0.5799451634E-01    0.2044034495E-02        15     3
 intlbfgs> Mean deviation     0.8043317385E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6198728985     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18412E-02 d,cutoff=     2.8033         2.8733     max grad=    0.58010E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823299900        0.8023634256E-02
 intlbfgs> Highest QCI image energy=    0.2747675624E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2747675624E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1080   -0.1000000000+201    0.1841170306E-02   -0.1000000000+201    0.5801035355E-01    0.8564617451E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6195242349     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.60267E-02 d,ref,cutoff=     1.5661         1.6201        0.51284E-01 max grad=     4.2078    
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18362E-02 d,cutoff=     2.8034         2.8733     max grad=    0.61580E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8822614720        0.4669471978E-02
 intlbfgs> Highest QCI image energy=    0.1293946478E-01 images=       1
 intlbfgs> Highest image        2 energy     0.1293946478E-01 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1081    0.6026682958E-02    0.1836161381E-02     4.207760113        0.6158040450E-01    0.3707080048E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6198720912     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18407E-02 d,cutoff=     2.8033         2.8733     max grad=    0.57962E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823308926        0.7945978102E-02
 intlbfgs> Highest QCI image energy=    0.2745988252E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2745988252E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1082   -0.1000000000+201    0.1840702240E-02   -0.1000000000+201    0.5796204205E-01    0.3701483987E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6198712959     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18403E-02 d,cutoff=     2.8033         2.8733     max grad=    0.57925E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823315770        0.7877835809E-02
 intlbfgs> Highest QCI image energy=    0.2744689944E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2744689944E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1083   -0.1000000000+201    0.1840333480E-02   -0.1000000000+201    0.5792511536E-01    0.1730578680E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6197473112     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.12856E-03 d,ref,cutoff=     1.5684         1.6201        0.51284E-01 max grad=    0.58794    
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18282E-02 d,cutoff=     2.8035         2.8733     max grad=    0.55974E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823625327        0.4206849427E-03
 intlbfgs> Highest QCI image energy=    0.2927718344E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2927718344E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1084    0.1285643802E-03    0.1828163701E-02    0.5879357531        0.5597360619E-01    0.1350909449E-02        15     3
 intlbfgs> Mean deviation     0.4206849427E-03 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6198702771     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18399E-02 d,cutoff=     2.8033         2.8733     max grad=    0.57873E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823325355        0.7777566916E-02
 intlbfgs> Highest QCI image energy=    0.2742877983E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2742877983E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1085   -0.1000000000+201    0.1839855140E-02   -0.1000000000+201    0.5787252433E-01    0.1331284565E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6198690640     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18395E-02 d,cutoff=     2.8033         2.8733     max grad=    0.57833E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823332263        0.7674471768E-02
 intlbfgs> Highest QCI image energy=    0.2741544297E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2741544297E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1086   -0.1000000000+201    0.1839539591E-02   -0.1000000000+201    0.5783255379E-01    0.1835479281E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6198380956     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.40483E-02 d,ref,cutoff=     1.5666         1.6201        0.51284E-01 max grad=     3.4179    
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.17902E-02 d,cutoff=     2.8042         2.8733     max grad=    0.55814E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823752579        0.5016449999E-02
 intlbfgs> Highest QCI image energy=    0.8021241698E-02 images=       1
 intlbfgs> Highest image        2 energy     0.8021241698E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1087    0.4048320301E-02    0.1790207835E-02     3.417887795        0.5581410242E-01    0.2314052189E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6198497167     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18365E-02 d,cutoff=     2.8034         2.8733     max grad=    0.57253E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823430906        0.6043093795E-02
 intlbfgs> Highest QCI image energy=    0.2723747907E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2723747907E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1088   -0.1000000000+201    0.1836520116E-02   -0.1000000000+201    0.5725286821E-01    0.2233388891E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6198434676     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18355E-02 d,cutoff=     2.8034         2.8733     max grad=    0.57071E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823461946        0.5524764281E-02
 intlbfgs> Highest QCI image energy=    0.2718169367E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2718169367E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1089   -0.1000000000+201    0.1835520236E-02   -0.1000000000+201    0.5707145545E-01    0.8171446913E-04        15     3
 intlbfgs> Mean deviation     0.5524764281E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197531201     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     40 atoms      7    10 value=    0.30346E-03 d,ref,cutoff=     3.3007         3.3911        0.89355E-01 max grad=    0.37185    
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18290E-02 d,cutoff=     2.8035         2.8733     max grad=    0.57452E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823411045        0.2273007384E-02
 intlbfgs> Highest QCI image energy=    0.3028177275E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3028177275E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1090    0.3034642217E-03    0.1828975267E-02    0.3718542949        0.5745211854E-01    0.1037109624E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6198488204     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18369E-02 d,cutoff=     2.8033         2.8733     max grad=    0.57429E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823400944        0.6242124579E-02
 intlbfgs> Highest QCI image energy=    0.2728779696E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2728779696E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1091   -0.1000000000+201    0.1836946048E-02   -0.1000000000+201    0.5742890806E-01    0.1071536166E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6198484987     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18370E-02 d,cutoff=     2.8033         2.8733     max grad=    0.57464E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823394660        0.6266213241E-02
 intlbfgs> Highest QCI image energy=    0.2729796952E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2729796952E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1092   -0.1000000000+201    0.1837048576E-02   -0.1000000000+201    0.5746404746E-01    0.1254292880E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6197433768     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.77515E-02 d,ref,cutoff=     1.5657         1.6201        0.51284E-01 max grad=     4.8030    
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18326E-02 d,cutoff=     2.8034         2.8733     max grad=    0.59814E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8822911451        0.2324098822E-02
 intlbfgs> Highest QCI image energy=    0.1073218139E-01 images=       1
 intlbfgs> Highest image        2 energy     0.1073218139E-01 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1093    0.7751503785E-02    0.1832593146E-02     4.803027844        0.5981369259E-01    0.2570396826E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6198470542     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     40 atoms      7    10 value=    0.75759E-06 d,ref,cutoff=     3.3017         3.3911        0.89355E-01 max grad=    0.18366E-01
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18385E-02 d,cutoff=     2.8033         2.8733     max grad=    0.57849E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823328470        0.6668952370E-02
 intlbfgs> Highest QCI image energy=    0.2742052272E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2742052272E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1094    0.7575928549E-06    0.1838457798E-02    0.1836609084E-01    0.5784937300E-01    0.2534713774E-02        15     3
 intlbfgs> Mean deviation     0.6668952370E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6198649017     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18224E-02 d,cutoff=     2.8036         2.8733     max grad=    0.53473E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8824088855        0.2042400304E-02
 intlbfgs> Highest QCI image energy=    0.2615232521E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2615232521E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1095   -0.1000000000+201    0.1822377306E-02   -0.1000000000+201    0.5347283105E-01    0.1442190465E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6198563238     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18388E-02 d,cutoff=     2.8033         2.8733     max grad=    0.56140E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823593640        0.4216180380E-02
 intlbfgs> Highest QCI image energy=    0.2696274008E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2696274008E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1096   -0.1000000000+201    0.1838789100E-02   -0.1000000000+201    0.5613983398E-01    0.8961478947E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6198204373     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18423E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57879E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823299997        0.4128318407E-02
 intlbfgs> Highest QCI image energy=    0.2745067740E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2745067740E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1097   -0.1000000000+201    0.1842326500E-02   -0.1000000000+201    0.5787870545E-01    0.6351423269E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6197583966     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     49 atoms     14    15 value=    0.49119E-03 d,ref,cutoff=     1.5672         1.6211        0.53052E-01 max grad=     1.1840    
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18391E-02 d,cutoff=     2.8033         2.8733     max grad=    0.58874E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823151110        0.2211371794E-02
 intlbfgs> Highest QCI image energy=    0.3340671535E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3340671535E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1098    0.4911945718E-03    0.1839124100E-02     1.184023912        0.5887437142E-01    0.8531258941E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6198183644     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18432E-02 d,cutoff=     2.8032         2.8733     max grad=    0.58095E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823262211        0.4269433601E-02
 intlbfgs> Highest QCI image energy=    0.2751595832E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2751595832E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1099   -0.1000000000+201    0.1843175784E-02   -0.1000000000+201    0.5809455821E-01    0.8335478398E-03        15     3
 intlbfgs> Mean deviation     0.4269433601E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6198174966     for atom     10 and images      1     2 total images=     1
 checkrep> number of active repulsions and total=      56      56
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18435E-02 d,cutoff=     2.8032         2.8733     max grad=    0.58158E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823250286        0.4296204250E-02
 intlbfgs> Highest QCI image energy=    0.2753614417E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2753614417E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1100   -0.1000000000+201    0.1843528234E-02   -0.1000000000+201    0.5815846645E-01    0.2152345242E-04        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.6197983517     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.44511E-02 d,ref,cutoff=     1.5665         1.6201        0.51284E-01 max grad=     3.5904    
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18304E-02 d,cutoff=     2.8035         2.8733     max grad=    0.59471E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823003928        0.5351213448E-02
 intlbfgs> Highest QCI image energy=    0.7296084272E-02 images=       1
 intlbfgs> Highest image        2 energy     0.7296084272E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1101    0.4451079746E-02    0.1830391587E-02     3.590440079        0.5947068927E-01    0.1999046038E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6198144103     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18448E-02 d,cutoff=     2.8032         2.8733     max grad=    0.58371E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823211051        0.4371388813E-02
 intlbfgs> Highest QCI image energy=    0.2760444758E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2760444758E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1102   -0.1000000000+201    0.1844812896E-02   -0.1000000000+201    0.5837070585E-01    0.1982520185E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6198138348     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18449E-02 d,cutoff=     2.8032         2.8733     max grad=    0.58397E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823206260        0.4373260976E-02
 intlbfgs> Highest QCI image energy=    0.2761220372E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2761220372E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1103   -0.1000000000+201    0.1844890935E-02   -0.1000000000+201    0.5839701634E-01    0.9938094102E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6196987079     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.79161E-03 d,ref,cutoff=     1.5678         1.6201        0.51284E-01 max grad=     1.4761    
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18372E-02 d,cutoff=     2.8033         2.8733     max grad=    0.61233E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8822731922        0.2720056416E-02
 intlbfgs> Highest QCI image energy=    0.4872515805E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4872515805E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1104    0.7916066951E-03    0.1837206073E-02     1.476136565        0.6123255654E-01    0.1660784568E-02        15     3
 intlbfgs> Mean deviation     0.2720056416E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6198130594     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     40 atoms      7    10 value=    0.72873E-09 d,ref,cutoff=     3.3018         3.3911        0.89355E-01 max grad=    0.56926E-03
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18451E-02 d,cutoff=     2.8032         2.8733     max grad=    0.58442E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823197828        0.4379443469E-02
 intlbfgs> Highest QCI image energy=    0.2762629916E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2762629916E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1105    0.7287334400E-09    0.1845116115E-02    0.5692553184E-03    0.5844200927E-01    0.1649591852E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6198127471     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     40 atoms      7    10 value=    0.59023E-08 d,ref,cutoff=     3.3018         3.3911        0.89355E-01 max grad=    0.16201E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18450E-02 d,cutoff=     2.8032         2.8733     max grad=    0.58434E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823199245        0.4357398499E-02
 intlbfgs> Highest QCI image energy=    0.2762315391E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2762315391E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1106    0.5902325975E-08    0.1844985511E-02    0.1620129634E-02    0.5843448580E-01    0.5955824583E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6198038099     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     49 atoms     14    15 value=    0.37611E-04 d,ref,cutoff=     1.5678         1.6211        0.53052E-01 max grad=    0.32402    
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18317E-02 d,cutoff=     2.8034         2.8733     max grad=    0.57077E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823453287        0.2560628832E-02
 intlbfgs> Highest QCI image energy=    0.2753104392E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2753104392E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1107    0.3761133938E-04    0.1831723062E-02    0.3240246213        0.5707655753E-01    0.5530552620E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6198113993     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     40 atoms      7    10 value=    0.49966E-07 d,ref,cutoff=     3.3017         3.3911        0.89355E-01 max grad=    0.47143E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18445E-02 d,cutoff=     2.8032         2.8733     max grad=    0.58403E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823204506        0.4247601708E-02
 intlbfgs> Highest QCI image energy=    0.2761089850E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2761089850E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1108    0.4996569240E-07    0.1844513724E-02    0.4714325571E-02    0.5840324713E-01    0.5335907440E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6198106179     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     40 atoms      7    10 value=    0.64731E-07 d,ref,cutoff=     3.3017         3.3911        0.89355E-01 max grad=    0.53660E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18441E-02 d,cutoff=     2.8032         2.8733     max grad=    0.58359E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823212106        0.4150311807E-02
 intlbfgs> Highest QCI image energy=    0.2759504117E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2759504117E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1109    0.6473137728E-07    0.1844060338E-02    0.5366005973E-02    0.5835906421E-01    0.2361916026E-04        15     3
 intlbfgs> Mean deviation     0.4150311807E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197524289     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24765E-02 d,ref,cutoff=     1.5671         1.6201        0.51284E-01 max grad=     2.6489    
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18108E-02 d,cutoff=     2.8038         2.8733     max grad=    0.54949E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823810476        0.3488189978E-02
 intlbfgs> Highest QCI image energy=    0.5257894355E-02 images=       1
 intlbfgs> Highest image        2 energy     0.5257894355E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1110    0.2476492735E-02    0.1810784123E-02     2.648854110        0.5494874138E-01    0.1827414653E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6198104355     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     40 atoms      7    10 value=    0.41013E-07 d,ref,cutoff=     3.3017         3.3911        0.89355E-01 max grad=    0.42711E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18440E-02 d,cutoff=     2.8032         2.8733     max grad=    0.58339E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823215386        0.4107989653E-02
 intlbfgs> Highest QCI image energy=    0.2758842445E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2758842445E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1111    0.4101306942E-07    0.1843957890E-02    0.4271094398E-02    0.5833891641E-01    0.1820340851E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6198102310     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     40 atoms      7    10 value=    0.28165E-07 d,ref,cutoff=     3.3018         3.3911        0.89355E-01 max grad=    0.35393E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18438E-02 d,cutoff=     2.8032         2.8733     max grad=    0.58319E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823218634        0.4067677616E-02
 intlbfgs> Highest QCI image energy=    0.2758194748E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2758194748E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1112    0.2816481335E-07    0.1843837607E-02    0.3539330093E-02    0.5831942770E-01    0.7580199706E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6198004165     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.69905E-05 d,ref,cutoff=     1.5687         1.6201        0.51284E-01 max grad=    0.13628    
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18380E-02 d,cutoff=     2.8033         2.8733     max grad=    0.57509E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823356861        0.2393877081E-02
 intlbfgs> Highest QCI image energy=    0.2738964949E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2738964949E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1113    0.6990461304E-05    0.1837997185E-02    0.1362809031        0.5750877550E-01    0.3290300457E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6198094408     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     40 atoms      7    10 value=    0.57800E-08 d,ref,cutoff=     3.3018         3.3911        0.89355E-01 max grad=    0.16033E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18435E-02 d,cutoff=     2.8032         2.8733     max grad=    0.58258E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823228930        0.3931792948E-02
 intlbfgs> Highest QCI image energy=    0.2756170726E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2756170726E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1114    0.5779998627E-08    0.1843459279E-02    0.1603260475E-02    0.5825782475E-01    0.3054788795E-03        15     3
 intlbfgs> Mean deviation     0.3931792948E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6198087112     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     40 atoms      7    10 value=    0.13359E-08 d,ref,cutoff=     3.3018         3.3911        0.89355E-01 max grad=    0.77076E-03
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18431E-02 d,cutoff=     2.8032         2.8733     max grad=    0.58207E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823237626        0.3819997472E-02
 intlbfgs> Highest QCI image energy=    0.2754464823E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2754464823E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1115    0.1335909604E-08    0.1843093513E-02    0.7707566954E-03    0.5820679277E-01    0.2043441121E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6197741100     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.33291E-03 d,ref,cutoff=     1.5682         1.6201        0.51284E-01 max grad=    0.95076    
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18253E-02 d,cutoff=     2.8036         2.8733     max grad=    0.55938E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823633501        0.1160763162E-02
 intlbfgs> Highest QCI image energy=    0.3034729790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3034729790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1116    0.3329138371E-03    0.1825286484E-02    0.9507579626        0.5593775388E-01    0.9479256992E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6198083106     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     40 atoms      7    10 value=    0.21128E-08 d,ref,cutoff=     3.3018         3.3911        0.89355E-01 max grad=    0.96930E-03
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18429E-02 d,cutoff=     2.8032         2.8733     max grad=    0.58185E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823241400        0.3770183122E-02
 intlbfgs> Highest QCI image energy=    0.2753721872E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2753721872E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1117    0.2112751354E-08    0.1842909263E-02    0.9692954070E-03    0.5818522063E-01    0.9387650210E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6198079193     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     40 atoms      7    10 value=    0.27216E-08 d,ref,cutoff=     3.3018         3.3911        0.89355E-01 max grad=    0.11001E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18427E-02 d,cutoff=     2.8032         2.8733     max grad=    0.58164E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823245138        0.3720637721E-02
 intlbfgs> Highest QCI image energy=    0.2752987258E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2752987258E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1118    0.2721591355E-08    0.1842730487E-02    0.1100134081E-02    0.5816378015E-01    0.9059722930E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6197297732     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.17378E-02 d,ref,cutoff=     1.5674         1.6201        0.51284E-01 max grad=     2.2070    
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18089E-02 d,cutoff=     2.8039         2.8733     max grad=    0.53702E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8824027268        0.6884741213E-02
 intlbfgs> Highest QCI image energy=    0.4461630627E-02 images=       1
 intlbfgs> Highest image        2 energy     0.4461630627E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1119    0.1737781696E-02    0.1808925304E-02     2.207031503        0.5370183799E-01    0.1879973706E-02        15     3
 intlbfgs> Mean deviation     0.6884741213E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6198074562     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     40 atoms      7    10 value=    0.71716E-08 d,ref,cutoff=     3.3018         3.3911        0.89355E-01 max grad=    0.17859E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18425E-02 d,cutoff=     2.8032         2.8733     max grad=    0.58142E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823249100        0.3669770279E-02
 intlbfgs> Highest QCI image energy=    0.2752221184E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2752221184E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1120    0.7171623611E-08    0.1842522228E-02    0.1785883860E-02    0.5814190675E-01    0.1870802868E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6198070515     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     40 atoms      7    10 value=    0.84058E-08 d,ref,cutoff=     3.3018         3.3911        0.89355E-01 max grad=    0.19335E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18424E-02 d,cutoff=     2.8032         2.8733     max grad=    0.58121E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823252687        0.3620087319E-02
 intlbfgs> Highest QCI image energy=    0.2751523900E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2751523900E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1121    0.8405833069E-08    0.1842357348E-02    0.1933469276E-02    0.5812133742E-01    0.8451660729E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6197283200     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.11302E-02 d,ref,cutoff=     1.5676         1.6201        0.51284E-01 max grad=     1.7703    
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18116E-02 d,cutoff=     2.8038         2.8733     max grad=    0.53821E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8824007255        0.6872930536E-02
 intlbfgs> Highest QCI image energy=    0.3799565707E-02 images=       1
 intlbfgs> Highest image        2 energy     0.3799565707E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1122    0.1130221486E-02    0.1811583959E-02     1.770262989        0.5382085264E-01    0.1713558712E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6198065927     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     40 atoms      7    10 value=    0.73294E-08 d,ref,cutoff=     3.3018         3.3911        0.89355E-01 max grad=    0.18054E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18422E-02 d,cutoff=     2.8033         2.8733     max grad=    0.58098E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823256636        0.3561439675E-02
 intlbfgs> Highest QCI image energy=    0.2750760986E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2750760986E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1123    0.7329408717E-08    0.1842197960E-02    0.1805426417E-02    0.5809823978E-01    0.1704568114E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6198061353     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     40 atoms      7    10 value=    0.71915E-08 d,ref,cutoff=     3.3018         3.3911        0.89355E-01 max grad=    0.17884E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18420E-02 d,cutoff=     2.8033         2.8733     max grad=    0.58076E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823260499        0.3504442277E-02
 intlbfgs> Highest QCI image energy=    0.2750014548E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2750014548E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1124    0.7191507516E-08    0.1842036093E-02    0.1788361582E-02    0.5807578230E-01    0.8875047913E-05        15     3
 intlbfgs> Mean deviation     0.3504442277E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6196918346     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.57152E-02 d,ref,cutoff=     1.5662         1.6201        0.51284E-01 max grad=     4.0922    
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18040E-02 d,cutoff=     2.8040         2.8733     max grad=    0.55082E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823782046        0.6764378896E-02
 intlbfgs> Highest QCI image energy=    0.9064557024E-02 images=       1
 intlbfgs> Highest image        2 energy     0.9064557024E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1125    0.5715220736E-02    0.1803999957E-02     4.092198016        0.5508213195E-01    0.2337692905E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6198043204     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18414E-02 d,cutoff=     2.8033         2.8733     max grad=    0.57947E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823282950        0.3217314058E-02
 intlbfgs> Highest QCI image energy=    0.2745993460E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2745993460E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1126   -0.1000000000+201    0.1841375093E-02   -0.1000000000+201    0.5794747032E-01    0.2314228060E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6198045575     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     40 atoms      7    10 value=    0.15984E-08 d,ref,cutoff=     3.3018         3.3911        0.89355E-01 max grad=    0.84309E-03
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18415E-02 d,cutoff=     2.8033         2.8733     max grad=    0.57984E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823276482        0.3286621116E-02
 intlbfgs> Highest QCI image energy=    0.2747072451E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2747072451E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1127    0.1598371338E-08    0.1841484547E-02    0.8430855243E-03    0.5798424876E-01    0.1202082255E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6198034537     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     40 atoms      7    10 value=    0.43791E-06 d,ref,cutoff=     3.3017         3.3911        0.89355E-01 max grad=    0.17966E-01
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18418E-02 d,cutoff=     2.8033         2.8733     max grad=    0.58195E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823236760        0.3509354721E-02
 intlbfgs> Highest QCI image energy=    0.2753520546E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2753520546E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1128    0.4379120834E-06    0.1841837076E-02    0.1796584313E-01    0.5819451632E-01    0.1030208305E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6198034768     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     40 atoms      7    10 value=    0.10967E-07 d,ref,cutoff=     3.3018         3.3911        0.89355E-01 max grad=    0.22085E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18416E-02 d,cutoff=     2.8033         2.8733     max grad=    0.58030E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823266249        0.3256981937E-02
 intlbfgs> Highest QCI image energy=    0.2748381852E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2748381852E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1129    0.1096709959E-07    0.1841618401E-02    0.2208500823E-02    0.5802975947E-01    0.6589575536E-04        15     3
 intlbfgs> Mean deviation     0.3256981937E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6198025110     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     40 atoms      7    10 value=    0.32576E-08 d,ref,cutoff=     3.3018         3.3911        0.89355E-01 max grad=    0.12036E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18416E-02 d,cutoff=     2.8033         2.8733     max grad=    0.58019E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823266771        0.3162408720E-02
 intlbfgs> Highest QCI image energy=    0.2748014135E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2748014135E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1130    0.3257589623E-08    0.1841567725E-02    0.1203608144E-02    0.5801873336E-01    0.2124168323E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6197140388     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.63449E-02 d,ref,cutoff=     1.5660         1.6201        0.51284E-01 max grad=     4.3230    
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18380E-02 d,cutoff=     2.8033         2.8733     max grad=    0.57693E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823218547        0.4417525471E-02
 intlbfgs> Highest QCI image energy=    0.9944912633E-02 images=       1
 intlbfgs> Highest image        2 energy     0.9944912633E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1131    0.6344933004E-02    0.1838023381E-02     4.322954319        0.5769324217E-01    0.2042812998E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6198023176     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     40 atoms      7    10 value=    0.39906E-08 d,ref,cutoff=     3.3018         3.3911        0.89355E-01 max grad=    0.13322E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18416E-02 d,cutoff=     2.8033         2.8733     max grad=    0.58019E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823266528        0.3148383840E-02
 intlbfgs> Highest QCI image energy=    0.2748008295E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2748008295E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1132    0.3990584420E-08    0.1841558194E-02    0.1332161910E-02    0.5801890669E-01    0.2039112440E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6198021197     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     40 atoms      7    10 value=    0.42939E-08 d,ref,cutoff=     3.3018         3.3911        0.89355E-01 max grad=    0.13819E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18415E-02 d,cutoff=     2.8033         2.8733     max grad=    0.58018E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823266380        0.3132752066E-02
 intlbfgs> Highest QCI image energy=    0.2747986165E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2747986165E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1133    0.4293914590E-08    0.1841549809E-02    0.1381866689E-02    0.5801845537E-01    0.3726306741E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6194836141     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.65928E-01 d,ref,cutoff=     1.5603         1.6201        0.51284E-01 max grad=     15.424    
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18328E-02 d,cutoff=     2.8034         2.8733     max grad=    0.57418E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823192065        0.2255787402E-01
 intlbfgs> Highest QCI image energy=    0.7360644027E-01 images=       1
 intlbfgs> Highest image        2 energy     0.7360644027E-01 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1134    0.6592782534E-01    0.1832810580E-02     15.42361687        0.5741834194E-01    0.6164849095E-02        15     3
 intlbfgs> Mean deviation     0.2255787402E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6198019025     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     40 atoms      7    10 value=    0.58104E-08 d,ref,cutoff=     3.3018         3.3911        0.89355E-01 max grad=    0.16075E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18415E-02 d,cutoff=     2.8033         2.8733     max grad=    0.58018E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823266327        0.3116881057E-02
 intlbfgs> Highest QCI image energy=    0.2747953174E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2747953174E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1135    0.5810402332E-08    0.1841533150E-02    0.1607480853E-02    0.5801779309E-01    0.6161599280E-02        15     3
 intlbfgs> largest atomic distance between images is     0.6198016925     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.76298E-08 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.44942E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18415E-02 d,cutoff=     2.8033         2.8733     max grad=    0.58017E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823266263        0.3100822943E-02
 intlbfgs> Highest QCI image energy=    0.2747930350E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2747930350E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1136    0.7629813052E-08    0.1841521237E-02    0.4494220041E-02    0.5801709293E-01    0.3269032275E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6198014302     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.40758E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.10388E-01
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18415E-02 d,cutoff=     2.8033         2.8733     max grad=    0.58016E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823266313        0.3080619460E-02
 intlbfgs> Highest QCI image energy=    0.2747912550E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2747912550E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1137    0.4075828563E-07    0.1841506245E-02    0.1038820687E-01    0.5801573744E-01    0.3369500065E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6198014135     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.33466E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.94131E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18415E-02 d,cutoff=     2.8033         2.8733     max grad=    0.58015E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823266390        0.3079292435E-02
 intlbfgs> Highest QCI image energy=    0.2747895658E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2747895658E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1138    0.3346644318E-07    0.1841505675E-02    0.9413077968E-02    0.5801540286E-01    0.1018085976E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6198010298     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     49 atoms     14    15 value=    0.20514E-07 d,ref,cutoff=     1.5680         1.6211        0.53052E-01 max grad=    0.75355E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18415E-02 d,cutoff=     2.8033         2.8733     max grad=    0.58011E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823267173        0.3048790108E-02
 intlbfgs> Highest QCI image energy=    0.2747755277E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2747755277E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1139    0.2051412735E-07    0.1841489338E-02    0.7535540616E-02    0.5801090331E-01    0.9986276487E-05        15     3
 intlbfgs> Mean deviation     0.3048790108E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6198011983     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24854E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.81118E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18415E-02 d,cutoff=     2.8033         2.8733     max grad=    0.58013E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823266777        0.3060728754E-02
 intlbfgs> Highest QCI image energy=    0.2747819683E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2747819683E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1140    0.2485396939E-07    0.1841507791E-02    0.8111798618E-02    0.5801285436E-01    0.7233164387E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6198010546     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.23647E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.79124E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18415E-02 d,cutoff=     2.8033         2.8733     max grad=    0.58011E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823266994        0.3048622236E-02
 intlbfgs> Highest QCI image energy=    0.2747776636E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2747776636E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1141    0.2364730253E-07    0.1841507382E-02    0.7912414084E-02    0.5801133460E-01    0.1824465497E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6197740783     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     49 atoms     14    15 value=    0.13653E-03 d,ref,cutoff=     1.5676         1.6211        0.53052E-01 max grad=    0.61974    
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18414E-02 d,cutoff=     2.8033         2.8733     max grad=    0.57725E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823308213        0.7681494710E-03
 intlbfgs> Highest QCI image energy=    0.2876380429E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2876380429E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1142    0.1365285580E-03    0.1841400028E-02    0.6197435924        0.5772475322E-01    0.3409964426E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6198009189     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.23798E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.79376E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18415E-02 d,cutoff=     2.8033         2.8733     max grad=    0.58010E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823267195        0.3036842231E-02
 intlbfgs> Highest QCI image energy=    0.2747738083E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2747738083E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1143    0.2379799278E-07    0.1841508901E-02    0.7937588580E-02    0.5800986162E-01    0.3398330471E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6198007850     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.23849E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.79460E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18415E-02 d,cutoff=     2.8033         2.8733     max grad=    0.58008E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823267393        0.3025238312E-02
 intlbfgs> Highest QCI image energy=    0.2747701548E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2747701548E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1144    0.2384872797E-07    0.1841510416E-02    0.7946047335E-02    0.5800841450E-01    0.1173509613E-05        15     3
 intlbfgs> Mean deviation     0.3025238312E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6198007287     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24165E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.79986E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18415E-02 d,cutoff=     2.8033         2.8733     max grad=    0.58008E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823267475        0.3020187736E-02
 intlbfgs> Highest QCI image energy=    0.2747687121E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2747687121E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1145    0.2416524866E-07    0.1841512424E-02    0.7998609384E-02    0.5800779385E-01    0.2359237930E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6197998448     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.27107E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.84716E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18415E-02 d,cutoff=     2.8033         2.8733     max grad=    0.57998E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823268746        0.2940851896E-02
 intlbfgs> Highest QCI image energy=    0.2747461553E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2747461553E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1146    0.2710746654E-07    0.1841546828E-02    0.8471613871E-02    0.5799808402E-01    0.3610745476E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6197981777     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.29773E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.88784E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18416E-02 d,cutoff=     2.8033         2.8733     max grad=    0.57980E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823271133        0.2791457490E-02
 intlbfgs> Highest QCI image energy=    0.2747038412E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2747038412E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1147    0.2977264817E-07    0.1841614240E-02    0.8878361866E-02    0.5797988936E-01    0.6751958565E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6197936005     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.32522E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.92792E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18418E-02 d,cutoff=     2.8033         2.8733     max grad=    0.57930E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823277648        0.2382258231E-02
 intlbfgs> Highest QCI image energy=    0.2745884287E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2745884287E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1148    0.3252166375E-07    0.1841800873E-02    0.9279249052E-02    0.5793032836E-01    0.1846558008E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6197861517     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.33409E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.94050E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18421E-02 d,cutoff=     2.8033         2.8733     max grad=    0.57851E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823288104        0.1719336812E-02
 intlbfgs> Highest QCI image energy=    0.2744032318E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2744032318E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1149    0.3340881489E-07    0.1842100307E-02    0.9404974148E-02    0.5785091015E-01    0.2988761464E-04        15     3
 intlbfgs> Mean deviation     0.1719336812E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197709712     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     40 atoms      7    10 value=    0.18582E-07 d,ref,cutoff=     3.3018         3.3911        0.89355E-01 max grad=    0.28748E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18430E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57727E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823303914        0.4086433499E-03
 intlbfgs> Highest QCI image energy=    0.2741538850E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2741538850E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1150    0.1858232356E-07    0.1843009067E-02    0.2874814314E-02    0.5772690477E-01    0.5738926351E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6197794689     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     40 atoms      7    10 value=    0.79414E-08 d,ref,cutoff=     3.3018         3.3911        0.89355E-01 max grad=    0.18793E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18424E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57789E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823296074        0.1133256353E-02
 intlbfgs> Highest QCI image energy=    0.2742642772E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2742642772E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1151    0.7941367841E-08    0.1842431731E-02    0.1879288741E-02    0.5778890424E-01    0.3465677213E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6198195944     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.10371E-03 d,ref,cutoff=     1.5685         1.6201        0.51284E-01 max grad=    0.52770    
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18363E-02 d,cutoff=     2.8034         2.8733     max grad=    0.58056E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823267798        0.4854326603E-02
 intlbfgs> Highest QCI image energy=    0.2856110651E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2856110651E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1152    0.1037091137E-03    0.1836265196E-02    0.5276974767        0.5805579995E-01    0.2843043654E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6197793635     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24882E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.81164E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18424E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57784E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823296775        0.1120685967E-02
 intlbfgs> Highest QCI image energy=    0.2742497680E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2742497680E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1153    0.2488212633E-07    0.1842391914E-02    0.8116389377E-02    0.5778399223E-01    0.2814239322E-03        15     3
 intlbfgs> largest atomic distance between images is     0.6197785386     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.23484E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.78850E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18424E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57778E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823297604        0.1054459233E-02
 intlbfgs> Highest QCI image energy=    0.2742350746E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2742350746E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1154    0.2348359066E-07    0.1842402721E-02    0.7884970004E-02    0.5777788009E-01    0.3314949180E-05        15     3
 intlbfgs> Mean deviation     0.1054459233E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197790229     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24593E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80690E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18424E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57782E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823297074        0.1092632143E-02
 intlbfgs> Highest QCI image energy=    0.2742444018E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2742444018E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1155    0.2459269511E-07    0.1842400325E-02    0.8069041669E-02    0.5778161974E-01    0.2071690216E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6197789618     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24537E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80600E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18424E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57782E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823297010        0.1087841959E-02
 intlbfgs> Highest QCI image energy=    0.2742455314E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2742455314E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1156    0.2453732431E-07    0.1842405438E-02    0.8059951719E-02    0.5778186812E-01    0.1396662787E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6197778386     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24057E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.79806E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18425E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57787E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823295771        0.9992803466E-03
 intlbfgs> Highest QCI image energy=    0.2742673600E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2742673600E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1157    0.2405673394E-07    0.1842503612E-02    0.7980620603E-02    0.5778668901E-01    0.2632451146E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6197760883     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24405E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80382E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18427E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57794E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823293867        0.8606446662E-03
 intlbfgs> Highest QCI image energy=    0.2743009415E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743009415E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1158    0.2440531539E-07    0.1842657142E-02    0.8038237789E-02    0.5779398634E-01    0.4076811730E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6197716371     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.22242E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.76736E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18431E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57813E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823288917        0.5075942139E-03
 intlbfgs> Highest QCI image energy=    0.2743882254E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743882254E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1159    0.2224164088E-07    0.1843054382E-02    0.7673611410E-02    0.5781314347E-01    0.1053905027E-04        15     3
 intlbfgs> Mean deviation     0.5075942139E-03 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197651870     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.36392E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.98160E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18436E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57839E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823281932        0.7410478786E-05
 intlbfgs> Highest QCI image energy=    0.2745115814E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2745115814E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1160    0.3639213727E-07    0.1843620455E-02    0.9815961259E-02    0.5783949434E-01    0.1510603529E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6197684985     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24984E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.81330E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18433E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57826E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823285510        0.2564636700E-03
 intlbfgs> Highest QCI image energy=    0.2744482994E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2744482994E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1161    0.2498429964E-07    0.1843334303E-02    0.8133035727E-02    0.5782600456E-01    0.7742916583E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6197685639     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24625E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80743E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18433E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57826E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823285615        0.2609164768E-03
 intlbfgs> Highest QCI image energy=    0.2744464385E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2744464385E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1162    0.2462493536E-07    0.1843329382E-02    0.8074326299E-02    0.5782550763E-01    0.2299239893E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6197683636     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24476E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80498E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18433E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57826E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823285480        0.2436711350E-03
 intlbfgs> Highest QCI image energy=    0.2744488205E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2744488205E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1163    0.2447569635E-07    0.1843346681E-02    0.8049819210E-02    0.5782584268E-01    0.4294748722E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6197682338     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24595E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80694E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57826E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823285426        0.2327603517E-03
 intlbfgs> Highest QCI image energy=    0.2744497769E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2744497769E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1164    0.2459479803E-07    0.1843353325E-02    0.8069383284E-02    0.5782596400E-01    0.2059070655E-06        15     3
 intlbfgs> Mean deviation     0.2327603517E-03 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197672891     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.25041E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.81422E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57826E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.8823285160        0.1528015938E-03
 intlbfgs> Highest QCI image energy=    0.2744544624E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2744544624E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1165    0.2504076537E-07    0.1843393205E-02    0.8142221976E-02    0.5782628100E-01    0.1396867297E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6197651952     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.25249E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.81759E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18435E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57827E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823284627        0.2433262269E-04
 intlbfgs> Highest QCI image energy=    0.2744638663E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2744638663E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1166    0.2524856951E-07    0.1843476974E-02    0.8175940133E-02    0.5782678477E-01    0.3052567947E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6197607692     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.25718E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.82517E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18436E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57827E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823283604        0.3988584542E-03
 intlbfgs> Highest QCI image energy=    0.2744819019E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2744819019E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1167    0.2571843051E-07    0.1843645176E-02    0.8251671559E-02    0.5782743912E-01    0.6387160962E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6197515733     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.19467E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.71790E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18439E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57828E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823281927        0.1175444230E-02
 intlbfgs> Highest QCI image energy=    0.2745115931E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2745115931E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1168    0.1946700271E-07    0.1843945802E-02    0.7178980471E-02    0.5782750866E-01    0.1305389261E-04        15     3
 intlbfgs> largest atomic distance between images is     0.6197560984     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24484E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80512E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18438E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57828E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823282678        0.7938892690E-03
 intlbfgs> Highest QCI image energy=    0.2744982202E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2744982202E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1169    0.2448427559E-07    0.1843807506E-02    0.8051226983E-02    0.5782763095E-01    0.6441715613E-05        15     3
 intlbfgs> Mean deviation     0.7938892690E-03 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197559785     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24420E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80406E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18438E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57827E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823282708        0.8040434505E-03
 intlbfgs> Highest QCI image energy=    0.2744977061E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2744977061E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1170    0.2441992304E-07    0.1843806374E-02    0.8040638162E-02    0.5782745226E-01    0.1979058316E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6197558285     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24674E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80824E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18438E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57827E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823282810        0.8170276904E-03
 intlbfgs> Highest QCI image energy=    0.2744958892E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2744958892E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1171    0.2467417102E-07    0.1843799261E-02    0.8082391879E-02    0.5782695623E-01    0.3197803464E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6197555168     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24418E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80403E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18438E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57826E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823282929        0.8443866559E-03
 intlbfgs> Highest QCI image energy=    0.2744938022E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2744938022E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1172    0.2441764845E-07    0.1843797251E-02    0.8040263465E-02    0.5782620281E-01    0.4802708164E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6197541294     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24164E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.79984E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18438E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57823E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823283467        0.9665985961E-03
 intlbfgs> Highest QCI image energy=    0.2744842849E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2744842849E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1173    0.2416418651E-07    0.1843788554E-02    0.7998419570E-02    0.5782273364E-01    0.2129977580E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6197511248     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24109E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.79893E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18438E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57815E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823284612        0.1231764940E-02
 intlbfgs> Highest QCI image energy=    0.2744640689E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2744640689E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1174    0.2410937274E-07    0.1843773917E-02    0.7989340982E-02    0.5781523170E-01    0.4575014158E-05        15     3
 intlbfgs> Mean deviation     0.1231764940E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197471618     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24911E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.81210E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18437E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57805E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823286300        0.1582437122E-02
 intlbfgs> Highest QCI image energy=    0.2744342561E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2744342561E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1175    0.2491064188E-07    0.1843738070E-02    0.8121031868E-02    0.5780464122E-01    0.6176190593E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6197459520     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24153E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.79965E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18437E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57801E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823286833        0.1691066961E-02
 intlbfgs> Highest QCI image energy=    0.2744248523E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2744248523E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1176    0.2415266010E-07    0.1843735888E-02    0.7996509937E-02    0.5780111201E-01    0.1884309929E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6197461518     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24929E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.81240E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18437E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57801E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823286808        0.1674604632E-02
 intlbfgs> Highest QCI image energy=    0.2744252871E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2744252871E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1177    0.2492897443E-07    0.1843736543E-02    0.8124019658E-02    0.5780128447E-01    0.3417021304E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6197461002     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24536E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80597E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18437E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57801E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823286850        0.1679317422E-02
 intlbfgs> Highest QCI image energy=    0.2744245477E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2744245477E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1178    0.2453609791E-07    0.1843734310E-02    0.8059741735E-02    0.5780108603E-01    0.1085492221E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6197460787     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24495E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80529E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18437E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57801E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823286874        0.1681333659E-02
 intlbfgs> Highest QCI image energy=    0.2744241227E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2744241227E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1179    0.2449467348E-07    0.1843732261E-02    0.8052934456E-02    0.5780099179E-01    0.5413431414E-07        15     3
 intlbfgs> Mean deviation     0.1681333659E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197458795     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24081E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.79846E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18437E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57800E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823287255        0.1701487912E-02
 intlbfgs> Highest QCI image energy=    0.2744174040E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2744174040E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1180    0.2408087605E-07    0.1843695342E-02    0.7984616694E-02    0.5779967164E-01    0.8032502689E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6197456811     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.23915E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.79571E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18436E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57798E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823287820        0.1723411496E-02
 intlbfgs> Highest QCI image energy=    0.2744074192E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2744074192E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1181    0.2391534456E-07    0.1843637169E-02    0.7957123371E-02    0.5779782506E-01    0.1189754790E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6197454785     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.23376E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.78668E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18435E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57795E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288719        0.1749236624E-02
 intlbfgs> Highest QCI image energy=    0.2743915575E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743915575E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1182    0.2337567895E-07    0.1843540600E-02    0.7866822436E-02    0.5779507950E-01    0.1933986624E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6197453866     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24305E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80217E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18435E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57794E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823289040        0.1759985381E-02
 intlbfgs> Highest QCI image energy=    0.2743858967E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743858967E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1183    0.2430523629E-07    0.1843505536E-02    0.8021730820E-02    0.5779406415E-01    0.6910277972E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6197454558     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24553E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80625E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18435E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57794E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288951        0.1753478792E-02
 intlbfgs> Highest QCI image energy=    0.2743874663E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743874663E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1184    0.2455288409E-07    0.1843513052E-02    0.8062498750E-02    0.5779441103E-01    0.1949816094E-06        15     3
 intlbfgs> Mean deviation     0.1753478792E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197455253     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24687E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80845E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18435E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57795E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288919        0.1747569021E-02
 intlbfgs> Highest QCI image energy=    0.2743880206E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743880206E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1185    0.2468700932E-07    0.1843513329E-02    0.8084492744E-02    0.5779462274E-01    0.1306218589E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6197455969     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24731E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80916E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18435E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57795E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288909        0.1741671215E-02
 intlbfgs> Highest QCI image energy=    0.2743882094E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743882094E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1186    0.2473069082E-07    0.1843509812E-02    0.8091642801E-02    0.5779482394E-01    0.1487764904E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6197459289     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24873E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.81148E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18435E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57796E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288830        0.1713874560E-02
 intlbfgs> Highest QCI image energy=    0.2743895943E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743895943E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1187    0.2487261800E-07    0.1843494211E-02    0.8114830864E-02    0.5779591799E-01    0.6875700816E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6197465377     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24836E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.81088E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18435E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57798E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288636        0.1662281112E-02
 intlbfgs> Highest QCI image energy=    0.2743930250E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743930250E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1188    0.2483552626E-07    0.1843469325E-02    0.8108777411E-02    0.5779813757E-01    0.1248602463E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6197479431     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.26894E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.84382E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57804E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288122        0.1542035585E-02
 intlbfgs> Highest QCI image energy=    0.2744021097E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2744021097E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1189    0.2689420652E-07    0.1843407664E-02    0.8438204770E-02    0.5780371530E-01    0.2931449547E-05        15     3
 intlbfgs> Mean deviation     0.1542035585E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197474042     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24798E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.81026E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288316        0.1588181597E-02
 intlbfgs> Highest QCI image energy=    0.2743986652E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743986652E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1190    0.2479770633E-07    0.1843434593E-02    0.8102600557E-02    0.5780154170E-01    0.1155486263E-05        15     3
 intlbfgs> largest atomic distance between images is     0.6197474603     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24647E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80780E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288281        0.1583156922E-02
 intlbfgs> Highest QCI image energy=    0.2743992887E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743992887E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1191    0.2464711608E-07    0.1843432846E-02    0.8077957842E-02    0.5780184311E-01    0.1238579110E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6197475729     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24571E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80655E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288219        0.1573196867E-02
 intlbfgs> Highest QCI image energy=    0.2744003808E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2744003808E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1192    0.2457105926E-07    0.1843428537E-02    0.8065483254E-02    0.5780240885E-01    0.2451610905E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6197475719     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24566E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80647E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288220        0.1573303631E-02
 intlbfgs> Highest QCI image energy=    0.2744003656E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2744003656E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1193    0.2456603419E-07    0.1843428346E-02    0.8064658380E-02    0.5780241006E-01    0.4784190852E-08        15     3
 intlbfgs> largest atomic distance between images is     0.6197475637     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24559E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80635E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288225        0.1574086978E-02
 intlbfgs> Highest QCI image energy=    0.2744002802E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2744002802E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1194    0.2455906508E-07    0.1843427863E-02    0.8063514247E-02    0.5780239531E-01    0.1537974454E-07        15     3
 intlbfgs> Mean deviation     0.1574086978E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197475308     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24539E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80602E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288244        0.1577200700E-02
 intlbfgs> Highest QCI image energy=    0.2743999431E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743999431E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1195    0.2453882226E-07    0.1843426252E-02    0.8060190019E-02    0.5780232679E-01    0.5735631217E-07        15     3
 intlbfgs> largest atomic distance between images is     0.6197474478     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24523E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80576E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288291        0.1585034329E-02
 intlbfgs> Highest QCI image energy=    0.2743991032E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743991032E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1196    0.2452325193E-07    0.1843422417E-02    0.8057632158E-02    0.5780214900E-01    0.1417902274E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6197472874     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24491E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80523E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288383        0.1600204123E-02
 intlbfgs> Highest QCI image energy=    0.2743974819E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743974819E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1197    0.2449075430E-07    0.1843415040E-02    0.8052290889E-02    0.5780180657E-01    0.2742666483E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6197469613     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24991E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.81341E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57801E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288568        0.1631226230E-02
 intlbfgs> Highest QCI image energy=    0.2743942247E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743942247E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1198    0.2499070650E-07    0.1843399056E-02    0.8134074157E-02    0.5780114371E-01    0.5673770488E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6197470608     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24563E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80642E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57801E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288512        0.1621721138E-02
 intlbfgs> Highest QCI image energy=    0.2743952078E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743952078E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1199    0.2456321944E-07    0.1843404378E-02    0.8064196243E-02    0.5780133641E-01    0.1792182778E-06        15     3
 intlbfgs> Mean deviation     0.1621721138E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197470609     for atom     10 and images      1     2 total images=     1
 checkrep> number of active repulsions and total=      56      56
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24563E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80642E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57801E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288512        0.1621720530E-02
 intlbfgs> Highest QCI image energy=    0.2743952165E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743952165E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1200    0.2456316259E-07    0.1843404422E-02    0.8064186904E-02    0.5780133912E-01    0.5195803073E-08        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.6197470536     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24571E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80655E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57801E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288515        0.1622435414E-02
 intlbfgs> Highest QCI image energy=    0.2743951572E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743951572E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1201    0.2457139640E-07    0.1843404131E-02    0.8065538534E-02    0.5780132826E-01    0.1316889404E-07        15     3
 intlbfgs> largest atomic distance between images is     0.6197470477     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24571E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80655E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57801E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288517        0.1623004938E-02
 intlbfgs> Highest QCI image energy=    0.2743951174E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743951174E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1202    0.2457123911E-07    0.1843403920E-02    0.8065512713E-02    0.5780132171E-01    0.9848701109E-08        15     3
 intlbfgs> largest atomic distance between images is     0.6197470223     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24569E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80651E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57801E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288525        0.1625424686E-02
 intlbfgs> Highest QCI image energy=    0.2743949798E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743949798E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1203    0.2456886403E-07    0.1843403035E-02    0.8065122847E-02    0.5780130484E-01    0.4117974337E-07        15     3
 intlbfgs> largest atomic distance between images is     0.6197469699     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24573E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80659E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57801E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288538        0.1630383174E-02
 intlbfgs> Highest QCI image energy=    0.2743947529E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743947529E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1204    0.2457341595E-07    0.1843401249E-02    0.8065870009E-02    0.5780128913E-01    0.8389616692E-07        15     3
 intlbfgs> Mean deviation     0.1630383174E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197468458     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24483E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80510E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57801E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288561        0.1642067385E-02
 intlbfgs> Highest QCI image energy=    0.2743943422E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743943422E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1205    0.2448282335E-07    0.1843397293E-02    0.8050986759E-02    0.5780129325E-01    0.1971849433E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6197467903     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24550E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80620E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57801E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288571        0.1647287774E-02
 intlbfgs> Highest QCI image energy=    0.2743941671E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743941671E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1206    0.2455003070E-07    0.1843395430E-02    0.8062030714E-02    0.5780129712E-01    0.8833371503E-07        15     3
 intlbfgs> largest atomic distance between images is     0.6197467646     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24570E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80654E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57801E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288571        0.1649667631E-02
 intlbfgs> Highest QCI image energy=    0.2743941703E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743941703E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1207    0.2457026694E-07    0.1843394691E-02    0.8065353103E-02    0.5780132620E-01    0.4115757199E-07        15     3
 intlbfgs> largest atomic distance between images is     0.6197467318     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24576E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80664E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57801E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288568        0.1652698196E-02
 intlbfgs> Highest QCI image energy=    0.2743942119E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743942119E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1208    0.2457643916E-07    0.1843393877E-02    0.8066366183E-02    0.5780137404E-01    0.5292817756E-07        15     3
 intlbfgs> largest atomic distance between images is     0.6197467000     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24582E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80673E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57801E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288565        0.1655648700E-02
 intlbfgs> Highest QCI image energy=    0.2743942648E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743942648E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1209    0.2458210043E-07    0.1843393257E-02    0.8067295286E-02    0.5780142049E-01    0.5125202001E-07        15     3
 intlbfgs> Mean deviation     0.1655648700E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197466071     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24574E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80659E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288535        0.1664202239E-02
 intlbfgs> Highest QCI image energy=    0.2743948043E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743948043E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1210    0.2457389395E-07    0.1843392643E-02    0.8065948422E-02    0.5780166290E-01    0.1620687271E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6197464571     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24602E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80705E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288473        0.1678008194E-02
 intlbfgs> Highest QCI image energy=    0.2743959033E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743959033E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1211    0.2460178284E-07    0.1843392537E-02    0.8070524613E-02    0.5780211194E-01    0.2726808807E-06        15     3
 intlbfgs> largest atomic distance between images is     0.6197464867     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24592E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80689E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288460        0.1675221220E-02
 intlbfgs> Highest QCI image energy=    0.2743961262E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743961262E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1212    0.2459207125E-07    0.1843394051E-02    0.8068931366E-02    0.5780214109E-01    0.5185912237E-07        15     3
 intlbfgs> largest atomic distance between images is     0.6197465237     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24555E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80628E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288433        0.1671699252E-02
 intlbfgs> Highest QCI image energy=    0.2743965973E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743965973E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1213    0.2455497994E-07    0.1843396578E-02    0.8062843366E-02    0.5780223062E-01    0.7437351766E-07        15     3
 intlbfgs> largest atomic distance between images is     0.6197465563     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24579E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80668E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288403        0.1668568311E-02
 intlbfgs> Highest QCI image energy=    0.2743971301E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743971301E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1214    0.2457879188E-07    0.1843399122E-02    0.8066752285E-02    0.5780234131E-01    0.7325155379E-07        15     3
 intlbfgs> Mean deviation     0.1668568311E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465866     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24549E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80619E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288380        0.1665660396E-02
 intlbfgs> Highest QCI image energy=    0.2743975320E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743975320E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1215    0.2454912072E-07    0.1843401134E-02    0.8061881244E-02    0.5780242161E-01    0.6122921751E-07        15     3
 intlbfgs> largest atomic distance between images is     0.6197466070     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24553E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80625E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288364        0.1663682055E-02
 intlbfgs> Highest QCI image energy=    0.2743978258E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978258E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1216    0.2455293310E-07    0.1843402490E-02    0.8062507278E-02    0.5780248299E-01    0.4260350574E-07        15     3
 intlbfgs> largest atomic distance between images is     0.6197466252     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24563E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80641E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57803E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288349        0.1661906006E-02
 intlbfgs> Highest QCI image energy=    0.2743980866E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743980866E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1217    0.2456276129E-07    0.1843403653E-02    0.8064120951E-02    0.5780253803E-01    0.3811628818E-07        15     3
 intlbfgs> largest atomic distance between images is     0.6197466197     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24571E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80655E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57803E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288353        0.1662440148E-02
 intlbfgs> Highest QCI image energy=    0.2743980121E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743980121E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1218    0.2457112451E-07    0.1843403303E-02    0.8065493835E-02    0.5780252240E-01    0.1114985094E-07        15     3
 intlbfgs> largest atomic distance between images is     0.6197466212     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57803E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288352        0.1662294484E-02
 intlbfgs> Highest QCI image energy=    0.2743980320E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743980320E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1219    0.2456701431E-07    0.1843403406E-02    0.8064819144E-02    0.5780252632E-01    0.3160588781E-08        15     3
 intlbfgs> Mean deviation     0.1662294484E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197466212     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57803E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288352        0.1662295619E-02
 intlbfgs> Highest QCI image energy=    0.2743980323E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743980323E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1220    0.2456678542E-07    0.1843403413E-02    0.8064781569E-02    0.5780252619E-01    0.2133383528E-09        15     3
 intlbfgs> largest atomic distance between images is     0.6197466193     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24563E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80642E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57803E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288353        0.1662504654E-02
 intlbfgs> Highest QCI image energy=    0.2743980196E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743980196E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1221    0.2456302612E-07    0.1843403544E-02    0.8064164427E-02    0.5780251686E-01    0.6570902829E-08        15     3
 intlbfgs> largest atomic distance between images is     0.6197466146     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24560E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80636E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288355        0.1662996475E-02
 intlbfgs> Highest QCI image energy=    0.2743979795E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743979795E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1222    0.2455956957E-07    0.1843403680E-02    0.8063596941E-02    0.5780249708E-01    0.1135756618E-07        15     3
 intlbfgs> largest atomic distance between images is     0.6197466028     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24560E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80636E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1664235553E-02
 intlbfgs> Highest QCI image energy=    0.2743978723E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978723E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1223    0.2455957907E-07    0.1843403912E-02    0.8063598498E-02    0.5780244861E-01    0.2630829435E-07        15     3
 intlbfgs> largest atomic distance between images is     0.6197465845     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24531E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80589E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288369        0.1666175619E-02
 intlbfgs> Highest QCI image energy=    0.2743977229E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743977229E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1224    0.2453079337E-07    0.1843404584E-02    0.8058871004E-02    0.5780237002E-01    0.4666981493E-07        15     3
 intlbfgs> Mean deviation     0.1666175619E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465890     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24560E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80636E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288368        0.1665678479E-02
 intlbfgs> Highest QCI image energy=    0.2743977531E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743977531E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1225    0.2455961452E-07    0.1843404260E-02    0.8063604311E-02    0.5780239169E-01    0.1531979796E-07        15     3
 intlbfgs> largest atomic distance between images is     0.6197465885     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24564E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80643E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288368        0.1665733555E-02
 intlbfgs> Highest QCI image energy=    0.2743977488E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743977488E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1226    0.2456409931E-07    0.1843404265E-02    0.8064340600E-02    0.5780238975E-01    0.1154392263E-08        15     3
 intlbfgs> largest atomic distance between images is     0.6197465874     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80647E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288368        0.1665850461E-02
 intlbfgs> Highest QCI image energy=    0.2743977407E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743977407E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1227    0.2456656117E-07    0.1843404301E-02    0.8064744745E-02    0.5780238538E-01    0.2699841345E-08        15     3
 intlbfgs> largest atomic distance between images is     0.6197465870     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288369        0.1665890790E-02
 intlbfgs> Highest QCI image energy=    0.2743977385E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743977385E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1228    0.2456668281E-07    0.1843404315E-02    0.8064764713E-02    0.5780238403E-01    0.9246891310E-09        15     3
 intlbfgs> largest atomic distance between images is     0.6197465847     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24566E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80647E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288369        0.1666136745E-02
 intlbfgs> Highest QCI image energy=    0.2743977312E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743977312E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1229    0.2456646737E-07    0.1843404408E-02    0.8064729346E-02    0.5780237794E-01    0.5478646562E-08        15     3
 intlbfgs> Mean deviation     0.1666136745E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465767     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24600E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80702E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288368        0.1667023846E-02
 intlbfgs> Highest QCI image energy=    0.2743977468E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743977468E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1230    0.2459962225E-07    0.1843404795E-02    0.8070170189E-02    0.5780236849E-01    0.1968876190E-07        15     3
 intlbfgs> largest atomic distance between images is     0.6197465821     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288369        0.1666418323E-02
 intlbfgs> Highest QCI image energy=    0.2743977319E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743977319E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1231    0.2456713954E-07    0.1843404525E-02    0.8064839687E-02    0.5780237388E-01    0.1372196507E-07        15     3
 intlbfgs> largest atomic distance between images is     0.6197465820     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288369        0.1666430868E-02
 intlbfgs> Highest QCI image energy=    0.2743977384E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743977384E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1232    0.2456699183E-07    0.1843404537E-02    0.8064815440E-02    0.5780237585E-01    0.8181156357E-09        15     3
 intlbfgs> largest atomic distance between images is     0.6197465767     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24572E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80657E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288357        0.1667067580E-02
 intlbfgs> Highest QCI image energy=    0.2743979486E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743979486E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1233    0.2457233389E-07    0.1843405041E-02    0.8065692326E-02    0.5780243511E-01    0.2842174832E-07        15     3
 intlbfgs> largest atomic distance between images is     0.6197465762     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24563E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80641E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288355        0.1667131502E-02
 intlbfgs> Highest QCI image energy=    0.2743979834E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743979834E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1234    0.2456291242E-07    0.1843405101E-02    0.8064145743E-02    0.5780244597E-01    0.4600364108E-08        15     3
 intlbfgs> Mean deviation     0.1667131502E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465774     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288358        0.1666988094E-02
 intlbfgs> Highest QCI image energy=    0.2743979297E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743979297E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1235    0.2456661594E-07    0.1843404979E-02    0.8064753731E-02    0.5780243048E-01    0.7095453990E-08        15     3
 intlbfgs> largest atomic distance between images is     0.6197465773     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288358        0.1666991329E-02
 intlbfgs> Highest QCI image energy=    0.2743979311E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743979311E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1236    0.2456703918E-07    0.1843404978E-02    0.8064823209E-02    0.5780243099E-01    0.1984508659E-09        15     3
 intlbfgs> largest atomic distance between images is     0.6197465773     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288358        0.1666992564E-02
 intlbfgs> Highest QCI image energy=    0.2743979314E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743979314E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1237    0.2456706284E-07    0.1843404974E-02    0.8064827094E-02    0.5780243122E-01    0.1119804566E-09        15     3
 intlbfgs> largest atomic distance between images is     0.6197465773     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288358        0.1667003290E-02
 intlbfgs> Highest QCI image energy=    0.2743979326E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743979326E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1238    0.2456718605E-07    0.1843404950E-02    0.8064847319E-02    0.5780243235E-01    0.6846747477E-09        15     3
 intlbfgs> largest atomic distance between images is     0.6197465771     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80649E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288358        0.1667031764E-02
 intlbfgs> Highest QCI image energy=    0.2743979328E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743979328E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1239    0.2456735896E-07    0.1843404879E-02    0.8064875703E-02    0.5780243458E-01    0.1817670736E-08        15     3
 intlbfgs> Mean deviation     0.1667031764E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465767     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80649E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288358        0.1667097712E-02
 intlbfgs> Highest QCI image energy=    0.2743979308E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743979308E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1240    0.2456736101E-07    0.1843404718E-02    0.8064876040E-02    0.5780243878E-01    0.4045285931E-08        15     3
 intlbfgs> largest atomic distance between images is     0.6197465758     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24564E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80643E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288358        0.1667238813E-02
 intlbfgs> Highest QCI image energy=    0.2743979243E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743979243E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1241    0.2456413872E-07    0.1843404408E-02    0.8064347062E-02    0.5780244608E-01    0.8074579392E-08        15     3
 intlbfgs> largest atomic distance between images is     0.6197465760     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288358        0.1667207814E-02
 intlbfgs> Highest QCI image energy=    0.2743979247E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743979247E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1242    0.2456702049E-07    0.1843404461E-02    0.8064820141E-02    0.5780244448E-01    0.1708871612E-08        15     3
 intlbfgs> largest atomic distance between images is     0.6197465759     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288358        0.1667219645E-02
 intlbfgs> Highest QCI image energy=    0.2743979232E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743979232E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1243    0.2456694567E-07    0.1843404437E-02    0.8064807859E-02    0.5780244467E-01    0.6259311148E-09        15     3
 intlbfgs> largest atomic distance between images is     0.6197465757     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288358        0.1667252515E-02
 intlbfgs> Highest QCI image energy=    0.2743979200E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743979200E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1244    0.2456699513E-07    0.1843404373E-02    0.8064815978E-02    0.5780244548E-01    0.1677317086E-08        15     3
 intlbfgs> Mean deviation     0.1667252515E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465757     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80647E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288358        0.1667256478E-02
 intlbfgs> Highest QCI image energy=    0.2743979194E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743979194E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1245    0.2456650022E-07    0.1843404370E-02    0.8064734733E-02    0.5780244538E-01    0.9552514019E-10        15     3
 intlbfgs> largest atomic distance between images is     0.6197465757     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80647E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288358        0.1667259495E-02
 intlbfgs> Highest QCI image energy=    0.2743979191E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743979191E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1246    0.2456655179E-07    0.1843404368E-02    0.8064743200E-02    0.5780244534E-01    0.6917738498E-10        15     3
 intlbfgs> largest atomic distance between images is     0.6197465748     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24568E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80649E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288359        0.1667374376E-02
 intlbfgs> Highest QCI image energy=    0.2743979065E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743979065E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1247    0.2456751690E-07    0.1843404277E-02    0.8064901629E-02    0.5780244336E-01    0.2496216553E-08        15     3
 intlbfgs> largest atomic distance between images is     0.6197465736     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24568E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80650E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288360        0.1667511934E-02
 intlbfgs> Highest QCI image energy=    0.2743978909E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978909E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1248    0.2456782230E-07    0.1843404183E-02    0.8064951762E-02    0.5780244042E-01    0.2804901475E-08        15     3
 intlbfgs> largest atomic distance between images is     0.6197465717     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80649E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1667740489E-02
 intlbfgs> Highest QCI image energy=    0.2743978648E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978648E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1249    0.2456733068E-07    0.1843404050E-02    0.8064871058E-02    0.5780243477E-01    0.4488392648E-08        15     3
 intlbfgs> Mean deviation     0.1667740489E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465713     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288362        0.1667784648E-02
 intlbfgs> Highest QCI image energy=    0.2743978604E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978604E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1250    0.2456708632E-07    0.1843404031E-02    0.8064830946E-02    0.5780243369E-01    0.8592764237E-09        15     3
 intlbfgs> largest atomic distance between images is     0.6197465715     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288362        0.1667760959E-02
 intlbfgs> Highest QCI image energy=    0.2743978633E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978633E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1251    0.2456661538E-07    0.1843404058E-02    0.8064753637E-02    0.5780243395E-01    0.6453989038E-09        15     3
 intlbfgs> largest atomic distance between images is     0.6197465717     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24566E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80647E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1667737855E-02
 intlbfgs> Highest QCI image energy=    0.2743978664E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978664E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1252    0.2456627395E-07    0.1843404100E-02    0.8064697588E-02    0.5780243381E-01    0.9529508669E-09        15     3
 intlbfgs> largest atomic distance between images is     0.6197465716     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24566E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80647E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1667730118E-02
 intlbfgs> Highest QCI image energy=    0.2743978695E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978695E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1253    0.2456610564E-07    0.1843404209E-02    0.8064669957E-02    0.5780243158E-01    0.2530618509E-08        15     3
 intlbfgs> largest atomic distance between images is     0.6197465707     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24566E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80647E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1667820493E-02
 intlbfgs> Highest QCI image energy=    0.2743978635E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978635E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1254    0.2456601826E-07    0.1843404317E-02    0.8064655614E-02    0.5780242594E-01    0.3399104100E-08        15     3
 intlbfgs> Mean deviation     0.1667820493E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465708     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80647E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1667805922E-02
 intlbfgs> Highest QCI image energy=    0.2743978645E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978645E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1255    0.2456655461E-07    0.1843404297E-02    0.8064743661E-02    0.5780242692E-01    0.6098366524E-09        15     3
 intlbfgs> largest atomic distance between images is     0.6197465706     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288362        0.1667836247E-02
 intlbfgs> Highest QCI image energy=    0.2743978615E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978615E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1256    0.2456677888E-07    0.1843404286E-02    0.8064780477E-02    0.5780242612E-01    0.5383531308E-09        15     3
 intlbfgs> largest atomic distance between images is     0.6197465699     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288362        0.1667916029E-02
 intlbfgs> Highest QCI image energy=    0.2743978539E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978539E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1257    0.2456682311E-07    0.1843404259E-02    0.8064787736E-02    0.5780242410E-01    0.1406473853E-08        15     3
 intlbfgs> largest atomic distance between images is     0.6197465695     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80649E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288362        0.1667967028E-02
 intlbfgs> Highest QCI image energy=    0.2743978497E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978497E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1258    0.2456740522E-07    0.1843404236E-02    0.8064883294E-02    0.5780242318E-01    0.9025872598E-09        15     3
 intlbfgs> largest atomic distance between images is     0.6197465695     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288362        0.1667959736E-02
 intlbfgs> Highest QCI image energy=    0.2743978502E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978502E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1259    0.2456692432E-07    0.1843404243E-02    0.8064804350E-02    0.5780242320E-01    0.1690967642E-09        15     3
 intlbfgs> Mean deviation     0.1667959736E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465695     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288362        0.1667962570E-02
 intlbfgs> Highest QCI image energy=    0.2743978501E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978501E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1260    0.2456682332E-07    0.1843404242E-02    0.8064787770E-02    0.5780242318E-01    0.4566244889E-10        15     3
 intlbfgs> largest atomic distance between images is     0.6197465694     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288362        0.1667972397E-02
 intlbfgs> Highest QCI image energy=    0.2743978500E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978500E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1261    0.2456662789E-07    0.1843404240E-02    0.8064755689E-02    0.5780242322E-01    0.1623393493E-09        15     3
 intlbfgs> largest atomic distance between images is     0.6197465692     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24566E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80647E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288362        0.1667991502E-02
 intlbfgs> Highest QCI image energy=    0.2743978499E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978499E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1262    0.2456644071E-07    0.1843404236E-02    0.8064724962E-02    0.5780242329E-01    0.3156682607E-09        15     3
 intlbfgs> largest atomic distance between images is     0.6197465687     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24566E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80647E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288362        0.1668051374E-02
 intlbfgs> Highest QCI image energy=    0.2743978496E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978496E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1263    0.2456613857E-07    0.1843404222E-02    0.8064675362E-02    0.5780242356E-01    0.9906321530E-09        15     3
 intlbfgs> largest atomic distance between images is     0.6197465678     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24566E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80647E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288362        0.1668160873E-02
 intlbfgs> Highest QCI image energy=    0.2743978491E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978491E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1264    0.2456599850E-07    0.1843404198E-02    0.8064652369E-02    0.5780242406E-01    0.1807946678E-08        15     3
 intlbfgs> Mean deviation     0.1668160873E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465660     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24566E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80646E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288362        0.1668368528E-02
 intlbfgs> Highest QCI image energy=    0.2743978491E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978491E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1265    0.2456590946E-07    0.1843404158E-02    0.8064637750E-02    0.5780242516E-01    0.3417694714E-08        15     3
 intlbfgs> largest atomic distance between images is     0.6197465662     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80647E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288362        0.1668340086E-02
 intlbfgs> Highest QCI image energy=    0.2743978489E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978489E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1266    0.2456651649E-07    0.1843404162E-02    0.8064737400E-02    0.5780242496E-01    0.4862910720E-09        15     3
 intlbfgs> largest atomic distance between images is     0.6197465663     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288362        0.1668333887E-02
 intlbfgs> Highest QCI image energy=    0.2743978491E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978491E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1267    0.2456674689E-07    0.1843404164E-02    0.8064775223E-02    0.5780242494E-01    0.1075924941E-09        15     3
 intlbfgs> largest atomic distance between images is     0.6197465663     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288362        0.1668333435E-02
 intlbfgs> Highest QCI image energy=    0.2743978492E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978492E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1268    0.2456688776E-07    0.1843404165E-02    0.8064798348E-02    0.5780242497E-01    0.3056934457E-10        15     3
 intlbfgs> largest atomic distance between images is     0.6197465663     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288362        0.1668335160E-02
 intlbfgs> Highest QCI image energy=    0.2743978495E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978495E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1269    0.2456694002E-07    0.1843404167E-02    0.8064806927E-02    0.5780242502E-01    0.4339057026E-10        15     3
 intlbfgs> Mean deviation     0.1668335160E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465662     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288362        0.1668341604E-02
 intlbfgs> Highest QCI image energy=    0.2743978505E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978505E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1270    0.2456700074E-07    0.1843404171E-02    0.8064816894E-02    0.5780242525E-01    0.1520138462E-09        15     3
 intlbfgs> largest atomic distance between images is     0.6197465661     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288362        0.1668356031E-02
 intlbfgs> Highest QCI image energy=    0.2743978533E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978533E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1271    0.2456708669E-07    0.1843404183E-02    0.8064831003E-02    0.5780242588E-01    0.3693542710E-09        15     3
 intlbfgs> largest atomic distance between images is     0.6197465657     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288362        0.1668388326E-02
 intlbfgs> Highest QCI image energy=    0.2743978602E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978602E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1272    0.2456712430E-07    0.1843404212E-02    0.8064837178E-02    0.5780242751E-01    0.8797686317E-09        15     3
 intlbfgs> largest atomic distance between images is     0.6197465652     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668438882E-02
 intlbfgs> Highest QCI image energy=    0.2743978718E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978718E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1273    0.2456707918E-07    0.1843404260E-02    0.8064829770E-02    0.5780243029E-01    0.1438263038E-08        15     3
 intlbfgs> largest atomic distance between images is     0.6197465648     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24566E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80647E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288360        0.1668483273E-02
 intlbfgs> Highest QCI image energy=    0.2743978822E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978822E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1274    0.2456638759E-07    0.1843404303E-02    0.8064716240E-02    0.5780243278E-01    0.1273831812E-08        15     3
 intlbfgs> Mean deviation     0.1668483273E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465650     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668462172E-02
 intlbfgs> Highest QCI image energy=    0.2743978777E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978777E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1275    0.2456675179E-07    0.1843404283E-02    0.8064776026E-02    0.5780243173E-01    0.5745635921E-09        15     3
 intlbfgs> largest atomic distance between images is     0.6197465650     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668459404E-02
 intlbfgs> Highest QCI image energy=    0.2743978773E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978773E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1276    0.2456681397E-07    0.1843404281E-02    0.8064786234E-02    0.5780243165E-01    0.6842181862E-10        15     3
 intlbfgs> largest atomic distance between images is     0.6197465650     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668460170E-02
 intlbfgs> Highest QCI image energy=    0.2743978776E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978776E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1277    0.2456682220E-07    0.1843404282E-02    0.8064787585E-02    0.5780243171E-01    0.2958659287E-10        15     3
 intlbfgs> largest atomic distance between images is     0.6197465650     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668459899E-02
 intlbfgs> Highest QCI image energy=    0.2743978776E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978776E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1278    0.2456681021E-07    0.1843404283E-02    0.8064785617E-02    0.5780243170E-01    0.9286402748E-11        15     3
 intlbfgs> largest atomic distance between images is     0.6197465650     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668458715E-02
 intlbfgs> Highest QCI image energy=    0.2743978776E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978776E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1279    0.2456679489E-07    0.1843404284E-02    0.8064783102E-02    0.5780243166E-01    0.4760754650E-10        15     3
 intlbfgs> Mean deviation     0.1668458715E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465651     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668455111E-02
 intlbfgs> Highest QCI image energy=    0.2743978775E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978775E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1280    0.2456678565E-07    0.1843404288E-02    0.8064781585E-02    0.5780243150E-01    0.1358936852E-09        15     3
 intlbfgs> largest atomic distance between images is     0.6197465651     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668444865E-02
 intlbfgs> Highest QCI image energy=    0.2743978771E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978771E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1281    0.2456661897E-07    0.1843404299E-02    0.8064754223E-02    0.5780243101E-01    0.3706511741E-09        15     3
 intlbfgs> largest atomic distance between images is     0.6197465652     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668439538E-02
 intlbfgs> Highest QCI image energy=    0.2743978769E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978769E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1282    0.2456671848E-07    0.1843404305E-02    0.8064770559E-02    0.5780243074E-01    0.1954532751E-09        15     3
 intlbfgs> largest atomic distance between images is     0.6197465652     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668430982E-02
 intlbfgs> Highest QCI image energy=    0.2743978764E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978764E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1283    0.2456681527E-07    0.1843404314E-02    0.8064786447E-02    0.5780243029E-01    0.3075178842E-09        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668425441E-02
 intlbfgs> Highest QCI image energy=    0.2743978760E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978760E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1284    0.2456682916E-07    0.1843404320E-02    0.8064788727E-02    0.5780242998E-01    0.1980959366E-09        15     3
 intlbfgs> Mean deviation     0.1668425441E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668425631E-02
 intlbfgs> Highest QCI image energy=    0.2743978760E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978760E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1285    0.2456680598E-07    0.1843404320E-02    0.8064784923E-02    0.5780242999E-01    0.1040270780E-10        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668425392E-02
 intlbfgs> Highest QCI image energy=    0.2743978761E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978761E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1286    0.2456680698E-07    0.1843404320E-02    0.8064785087E-02    0.5780242998E-01    0.8590087404E-11        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668423084E-02
 intlbfgs> Highest QCI image energy=    0.2743978762E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978762E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1287    0.2456680549E-07    0.1843404324E-02    0.8064784842E-02    0.5780242994E-01    0.8469707818E-10        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668421396E-02
 intlbfgs> Highest QCI image energy=    0.2743978767E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978767E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1288    0.2456682901E-07    0.1843404327E-02    0.8064788703E-02    0.5780242999E-01    0.7641131739E-10        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668417257E-02
 intlbfgs> Highest QCI image energy=    0.2743978779E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978779E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1289    0.2456678989E-07    0.1843404336E-02    0.8064782280E-02    0.5780243017E-01    0.1948217574E-09        15     3
 intlbfgs> Mean deviation     0.1668417257E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668416795E-02
 intlbfgs> Highest QCI image energy=    0.2743978785E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978785E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1290    0.2456684287E-07    0.1843404338E-02    0.8064790978E-02    0.5780243032E-01    0.6509587329E-10        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418396E-02
 intlbfgs> Highest QCI image energy=    0.2743978786E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978786E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1291    0.2456682799E-07    0.1843404337E-02    0.8064788535E-02    0.5780243040E-01    0.5754267000E-10        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668421567E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1292    0.2456680327E-07    0.1843404334E-02    0.8064784477E-02    0.5780243064E-01    0.1212455537E-09        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668422435E-02
 intlbfgs> Highest QCI image energy=    0.2743978792E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978792E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1293    0.2456682942E-07    0.1843404334E-02    0.8064788770E-02    0.5780243073E-01    0.3736508055E-10        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668421869E-02
 intlbfgs> Highest QCI image energy=    0.2743978791E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978791E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1294    0.2456681159E-07    0.1843404334E-02    0.8064785843E-02    0.5780243069E-01    0.2167021481E-10        15     3
 intlbfgs> Mean deviation     0.1668421869E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668421793E-02
 intlbfgs> Highest QCI image energy=    0.2743978791E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978791E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1295    0.2456681029E-07    0.1843404334E-02    0.8064785631E-02    0.5780243069E-01    0.2674475693E-11        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668421480E-02
 intlbfgs> Highest QCI image energy=    0.2743978792E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978792E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1296    0.2456680924E-07    0.1843404335E-02    0.8064785458E-02    0.5780243069E-01    0.1249041081E-10        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668420994E-02
 intlbfgs> Highest QCI image energy=    0.2743978793E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978793E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1297    0.2456680311E-07    0.1843404335E-02    0.8064784452E-02    0.5780243071E-01    0.2120275029E-10        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668420495E-02
 intlbfgs> Highest QCI image energy=    0.2743978795E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978795E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1298    0.2456680771E-07    0.1843404336E-02    0.8064785207E-02    0.5780243074E-01    0.2289411534E-10        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668420389E-02
 intlbfgs> Highest QCI image energy=    0.2743978795E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978795E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1299    0.2456681179E-07    0.1843404336E-02    0.8064785877E-02    0.5780243076E-01    0.9323438657E-11        15     3
 intlbfgs> Mean deviation     0.1668420389E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 checkrep> number of active repulsions and total=      56      56
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668420425E-02
 intlbfgs> Highest QCI image energy=    0.2743978796E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978796E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1300    0.2456681291E-07    0.1843404336E-02    0.8064786060E-02    0.5780243078E-01    0.8867926502E-11        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668420607E-02
 intlbfgs> Highest QCI image energy=    0.2743978796E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978796E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1301    0.2456681468E-07    0.1843404336E-02    0.8064786351E-02    0.5780243082E-01    0.1637291558E-10        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668421261E-02
 intlbfgs> Highest QCI image energy=    0.2743978797E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978797E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1302    0.2456682117E-07    0.1843404335E-02    0.8064787416E-02    0.5780243088E-01    0.3752210461E-10        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668421618E-02
 intlbfgs> Highest QCI image energy=    0.2743978798E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978798E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1303    0.2456680304E-07    0.1843404334E-02    0.8064784441E-02    0.5780243093E-01    0.2445971421E-10        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668421503E-02
 intlbfgs> Highest QCI image energy=    0.2743978797E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978797E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1304    0.2456680925E-07    0.1843404334E-02    0.8064785459E-02    0.5780243090E-01    0.1320008513E-10        15     3
 intlbfgs> Mean deviation     0.1668421503E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668421526E-02
 intlbfgs> Highest QCI image energy=    0.2743978797E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978797E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1305    0.2456681129E-07    0.1843404334E-02    0.8064785794E-02    0.5780243088E-01    0.5563886414E-11        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668421764E-02
 intlbfgs> Highest QCI image energy=    0.2743978795E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978795E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1306    0.2456681586E-07    0.1843404333E-02    0.8064786545E-02    0.5780243084E-01    0.2162545077E-10        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668422189E-02
 intlbfgs> Highest QCI image energy=    0.2743978793E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978793E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1307    0.2456681788E-07    0.1843404332E-02    0.8064786876E-02    0.5780243082E-01    0.2190018778E-10        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668422659E-02
 intlbfgs> Highest QCI image energy=    0.2743978789E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978789E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1308    0.2456677891E-07    0.1843404330E-02    0.8064780478E-02    0.5780243071E-01    0.4733703636E-10        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668422537E-02
 intlbfgs> Highest QCI image energy=    0.2743978792E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978792E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1309    0.2456680979E-07    0.1843404331E-02    0.8064785547E-02    0.5780243081E-01    0.3751082703E-10        15     3
 intlbfgs> Mean deviation     0.1668422537E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668422557E-02
 intlbfgs> Highest QCI image energy=    0.2743978792E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978792E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1310    0.2456681079E-07    0.1843404331E-02    0.8064785713E-02    0.5780243082E-01    0.4364320122E-11        15     3
 intlbfgs> largest atomic distance between images is     0.6197465652     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668422644E-02
 intlbfgs> Highest QCI image energy=    0.2743978793E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978793E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1311    0.2456680663E-07    0.1843404331E-02    0.8064785030E-02    0.5780243086E-01    0.2038091470E-10        15     3
 intlbfgs> largest atomic distance between images is     0.6197465652     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668422808E-02
 intlbfgs> Highest QCI image energy=    0.2743978793E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978793E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1312    0.2456681256E-07    0.1843404330E-02    0.8064786003E-02    0.5780243086E-01    0.1406631441E-10        15     3
 intlbfgs> largest atomic distance between images is     0.6197465652     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668422890E-02
 intlbfgs> Highest QCI image energy=    0.2743978792E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978792E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1313    0.2456681180E-07    0.1843404330E-02    0.8064785878E-02    0.5780243085E-01    0.7680199987E-11        15     3
 intlbfgs> largest atomic distance between images is     0.6197465652     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668423048E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1314    0.2456681203E-07    0.1843404329E-02    0.8064785915E-02    0.5780243082E-01    0.1855176379E-10        15     3
 intlbfgs> Mean deviation     0.1668423048E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465652     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668423075E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1315    0.2456680652E-07    0.1843404328E-02    0.8064785010E-02    0.5780243081E-01    0.6578908899E-11        15     3
 intlbfgs> largest atomic distance between images is     0.6197465652     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668423026E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1316    0.2456680704E-07    0.1843404328E-02    0.8064785096E-02    0.5780243080E-01    0.4036492647E-11        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668422425E-02
 intlbfgs> Highest QCI image energy=    0.2743978789E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978789E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1317    0.2456680695E-07    0.1843404330E-02    0.8064785081E-02    0.5780243073E-01    0.3875263795E-10        15     3
 intlbfgs> largest atomic distance between images is     0.6197465652     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668422560E-02
 intlbfgs> Highest QCI image energy=    0.2743978778E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978778E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1318    0.2456690357E-07    0.1843404326E-02    0.8064800943E-02    0.5780243046E-01    0.1084446824E-09        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668422448E-02
 intlbfgs> Highest QCI image energy=    0.2743978788E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978788E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1319    0.2456681118E-07    0.1843404329E-02    0.8064785776E-02    0.5780243072E-01    0.1035726635E-09        15     3
 intlbfgs> Mean deviation     0.1668422448E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668422439E-02
 intlbfgs> Highest QCI image energy=    0.2743978788E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978788E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1320    0.2456681112E-07    0.1843404329E-02    0.8064785767E-02    0.5780243072E-01    0.4138231137E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668422066E-02
 intlbfgs> Highest QCI image energy=    0.2743978789E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978789E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1321    0.2456680888E-07    0.1843404330E-02    0.8064785398E-02    0.5780243072E-01    0.1677366271E-10        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668421575E-02
 intlbfgs> Highest QCI image energy=    0.2743978789E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978789E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1322    0.2456681095E-07    0.1843404331E-02    0.8064785738E-02    0.5780243072E-01    0.2161884719E-10        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668419906E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1323    0.2456680004E-07    0.1843404332E-02    0.8064783948E-02    0.5780243070E-01    0.7366303717E-10        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418566E-02
 intlbfgs> Highest QCI image energy=    0.2743978791E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978791E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1324    0.2456682328E-07    0.1843404333E-02    0.8064787762E-02    0.5780243068E-01    0.5906704836E-10        15     3
 intlbfgs> Mean deviation     0.1668418566E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418904E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1325    0.2456681107E-07    0.1843404333E-02    0.8064785758E-02    0.5780243068E-01    0.1507098230E-10        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418939E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1326    0.2456681152E-07    0.1843404333E-02    0.8064785832E-02    0.5780243068E-01    0.2380130245E-11        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418907E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1327    0.2456680983E-07    0.1843404333E-02    0.8064785555E-02    0.5780243068E-01    0.1455405463E-11        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418889E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1328    0.2456681011E-07    0.1843404333E-02    0.8064785600E-02    0.5780243068E-01    0.7909960724E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418670E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1329    0.2456681233E-07    0.1843404333E-02    0.8064785965E-02    0.5780243068E-01    0.9799134690E-11        15     3
 intlbfgs> Mean deviation     0.1668418670E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418303E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1330    0.2456681255E-07    0.1843404333E-02    0.8064786002E-02    0.5780243067E-01    0.1652243624E-10        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668417932E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1331    0.2456681474E-07    0.1843404333E-02    0.8064786360E-02    0.5780243067E-01    0.1758442883E-10        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668416997E-02
 intlbfgs> Highest QCI image energy=    0.2743978789E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978789E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1332    0.2456680008E-07    0.1843404332E-02    0.8064783953E-02    0.5780243066E-01    0.4724379426E-10        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668417325E-02
 intlbfgs> Highest QCI image energy=    0.2743978789E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978789E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1333    0.2456681002E-07    0.1843404332E-02    0.8064785586E-02    0.5780243067E-01    0.1472320170E-10        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668417539E-02
 intlbfgs> Highest QCI image energy=    0.2743978789E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978789E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1334    0.2456681138E-07    0.1843404332E-02    0.8064785809E-02    0.5780243068E-01    0.1072117976E-10        15     3
 intlbfgs> Mean deviation     0.1668417539E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668417992E-02
 intlbfgs> Highest QCI image energy=    0.2743978789E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978789E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1335    0.2456681428E-07    0.1843404331E-02    0.8064786284E-02    0.5780243070E-01    0.2657482286E-10        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668417865E-02
 intlbfgs> Highest QCI image energy=    0.2743978789E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978789E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1336    0.2456680597E-07    0.1843404330E-02    0.8064784921E-02    0.5780243071E-01    0.1699898580E-10        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418003E-02
 intlbfgs> Highest QCI image energy=    0.2743978789E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978789E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1337    0.2456681165E-07    0.1843404330E-02    0.8064785852E-02    0.5780243071E-01    0.7691982899E-11        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418012E-02
 intlbfgs> Highest QCI image energy=    0.2743978789E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978789E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1338    0.2456681039E-07    0.1843404330E-02    0.8064785646E-02    0.5780243071E-01    0.4587875015E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418011E-02
 intlbfgs> Highest QCI image energy=    0.2743978789E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978789E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1339    0.2456681048E-07    0.1843404330E-02    0.8064785661E-02    0.5780243071E-01    0.1785630581E-12        15     3
 intlbfgs> Mean deviation     0.1668418011E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668417976E-02
 intlbfgs> Highest QCI image energy=    0.2743978789E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978789E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1340    0.2456681127E-07    0.1843404330E-02    0.8064785792E-02    0.5780243071E-01    0.3216570364E-11        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668417957E-02
 intlbfgs> Highest QCI image energy=    0.2743978789E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978789E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1341    0.2456681135E-07    0.1843404330E-02    0.8064785804E-02    0.5780243072E-01    0.2093311699E-11        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668417949E-02
 intlbfgs> Highest QCI image energy=    0.2743978789E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978789E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1342    0.2456680858E-07    0.1843404330E-02    0.8064785349E-02    0.5780243073E-01    0.4808055286E-11        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668417944E-02
 intlbfgs> Highest QCI image energy=    0.2743978789E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978789E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1343    0.2456680984E-07    0.1843404330E-02    0.8064785556E-02    0.5780243072E-01    0.5909988253E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668417959E-02
 intlbfgs> Highest QCI image energy=    0.2743978789E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978789E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1344    0.2456681059E-07    0.1843404330E-02    0.8064785680E-02    0.5780243073E-01    0.8183203546E-12        15     3
 intlbfgs> Mean deviation     0.1668417959E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418036E-02
 intlbfgs> Highest QCI image energy=    0.2743978789E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978789E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1345    0.2456681128E-07    0.1843404330E-02    0.8064785793E-02    0.5780243073E-01    0.4000501147E-11        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418121E-02
 intlbfgs> Highest QCI image energy=    0.2743978789E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978789E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1346    0.2456681266E-07    0.1843404330E-02    0.8064786020E-02    0.5780243074E-01    0.4505574174E-11        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418175E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1347    0.2456681081E-07    0.1843404330E-02    0.8064785715E-02    0.5780243075E-01    0.2845942164E-11        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418166E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1348    0.2456681071E-07    0.1843404330E-02    0.8064785698E-02    0.5780243075E-01    0.4780559704E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418164E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1349    0.2456681062E-07    0.1843404330E-02    0.8064785685E-02    0.5780243075E-01    0.1370209090E-12        15     3
 intlbfgs> Mean deviation     0.1668418164E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418163E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1350    0.2456681052E-07    0.1843404330E-02    0.8064785668E-02    0.5780243075E-01    0.1781634188E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418166E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1351    0.2456681049E-07    0.1843404330E-02    0.8064785663E-02    0.5780243075E-01    0.2080812192E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418179E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1352    0.2456681048E-07    0.1843404330E-02    0.8064785661E-02    0.5780243075E-01    0.7175324693E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418203E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1353    0.2456680997E-07    0.1843404330E-02    0.8064785578E-02    0.5780243075E-01    0.1373450364E-11        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418229E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1354    0.2456681056E-07    0.1843404330E-02    0.8064785674E-02    0.5780243075E-01    0.1443820716E-11        15     3
 intlbfgs> Mean deviation     0.1668418229E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418237E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1355    0.2456681067E-07    0.1843404330E-02    0.8064785692E-02    0.5780243075E-01    0.4640860503E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418242E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1356    0.2456681056E-07    0.1843404330E-02    0.8064785674E-02    0.5780243075E-01    0.2547696023E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418241E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1357    0.2456681065E-07    0.1843404330E-02    0.8064785690E-02    0.5780243075E-01    0.7646303408E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418241E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1358    0.2456681069E-07    0.1843404330E-02    0.8064785695E-02    0.5780243075E-01    0.6976224786E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418234E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1359    0.2456681086E-07    0.1843404330E-02    0.8064785724E-02    0.5780243075E-01    0.1586376684E-11        15     3
 intlbfgs> Mean deviation     0.1668418234E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418231E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1360    0.2456681140E-07    0.1843404330E-02    0.8064785812E-02    0.5780243075E-01    0.1695391624E-11        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418229E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1361    0.2456681100E-07    0.1843404330E-02    0.8064785747E-02    0.5780243075E-01    0.1456610110E-11        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418231E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1362    0.2456681059E-07    0.1843404330E-02    0.8064785680E-02    0.5780243075E-01    0.1104616855E-11        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418234E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1363    0.2456681050E-07    0.1843404330E-02    0.8064785665E-02    0.5780243075E-01    0.2799960494E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418260E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1364    0.2456681017E-07    0.1843404330E-02    0.8064785610E-02    0.5780243075E-01    0.1864484442E-11        15     3
 intlbfgs> Mean deviation     0.1668418260E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418295E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1365    0.2456681021E-07    0.1843404330E-02    0.8064785617E-02    0.5780243075E-01    0.1968058025E-11        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418358E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1366    0.2456680938E-07    0.1843404330E-02    0.8064785481E-02    0.5780243075E-01    0.3200202333E-11        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418339E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1367    0.2456681041E-07    0.1843404330E-02    0.8064785650E-02    0.5780243075E-01    0.1067876422E-11        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418338E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1368    0.2456681060E-07    0.1843404330E-02    0.8064785680E-02    0.5780243075E-01    0.2349590638E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418338E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1369    0.2456681066E-07    0.1843404330E-02    0.8064785691E-02    0.5780243075E-01    0.1563447989E-12        15     3
 intlbfgs> Mean deviation     0.1668418338E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418340E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1370    0.2456681068E-07    0.1843404330E-02    0.8064785694E-02    0.5780243075E-01    0.1198191393E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418344E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1371    0.2456681073E-07    0.1843404330E-02    0.8064785702E-02    0.5780243075E-01    0.3554443211E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418347E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1372    0.2456681035E-07    0.1843404330E-02    0.8064785640E-02    0.5780243075E-01    0.5282346949E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418346E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1373    0.2456681063E-07    0.1843404330E-02    0.8064785685E-02    0.5780243075E-01    0.3235730150E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418346E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1374    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.9857753173E-14        15     3
 intlbfgs> Mean deviation     0.1668418346E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418346E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1375    0.2456681060E-07    0.1843404330E-02    0.8064785681E-02    0.5780243075E-01    0.2601397995E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418346E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1376    0.2456681061E-07    0.1843404330E-02    0.8064785682E-02    0.5780243075E-01    0.2289919185E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418347E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1377    0.2456681061E-07    0.1843404330E-02    0.8064785682E-02    0.5780243075E-01    0.1306553579E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418348E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1378    0.2456681056E-07    0.1843404330E-02    0.8064785674E-02    0.5780243075E-01    0.1360224238E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418348E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1379    0.2456681061E-07    0.1843404330E-02    0.8064785682E-02    0.5780243075E-01    0.4340772022E-13        15     3
 intlbfgs> Mean deviation     0.1668418348E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418348E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1380    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1122653330E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418348E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1381    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2157544471E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418349E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1382    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.2518110233E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418350E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1383    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.5153724834E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418352E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1384    0.2456681060E-07    0.1843404330E-02    0.8064785681E-02    0.5780243075E-01    0.9283285855E-13        15     3
 intlbfgs> Mean deviation     0.1668418352E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418354E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1385    0.2456681063E-07    0.1843404330E-02    0.8064785686E-02    0.5780243075E-01    0.5880664262E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418355E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1386    0.2456681063E-07    0.1843404330E-02    0.8064785685E-02    0.5780243075E-01    0.1211297359E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418358E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1387    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.8107095567E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418360E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1388    0.2456681060E-07    0.1843404330E-02    0.8064785681E-02    0.5780243075E-01    0.6937219697E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418372E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1389    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.2518234227E-12        15     3
 intlbfgs> Mean deviation     0.1668418372E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418382E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1390    0.2456681045E-07    0.1843404330E-02    0.8064785656E-02    0.5780243075E-01    0.1877191709E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418375E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1391    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.1287466309E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418375E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1392    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.7280717778E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418374E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1393    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.1888722322E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418375E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1394    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4386106804E-14        15     3
 intlbfgs> Mean deviation     0.1668418375E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418377E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1395    0.2456681063E-07    0.1843404330E-02    0.8064785686E-02    0.5780243075E-01    0.2776240857E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418379E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1396    0.2456681064E-07    0.1843404330E-02    0.8064785687E-02    0.5780243075E-01    0.5153447080E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418388E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1397    0.2456681064E-07    0.1843404330E-02    0.8064785687E-02    0.5780243075E-01    0.1399851520E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418397E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1398    0.2456681063E-07    0.1843404330E-02    0.8064785685E-02    0.5780243075E-01    0.1555176159E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418395E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1399    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.4237097372E-13        15     3
 intlbfgs> Mean deviation     0.1668418395E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 checkrep> number of active repulsions and total=      56      56
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418395E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1400    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.1274986238E-13        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418394E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1401    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2118652686E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418394E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1402    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3779068801E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418395E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1403    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.8524562444E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418396E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1404    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1765059906E-13        15     3
 intlbfgs> Mean deviation     0.1668418396E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418398E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1405    0.2456681060E-07    0.1843404330E-02    0.8064785681E-02    0.5780243075E-01    0.4928034432E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418401E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1406    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.7778240542E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418402E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1407    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.2503072911E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418402E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1408    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4103322655E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418402E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1409    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.3487496842E-14        15     3
 intlbfgs> Mean deviation     0.1668418402E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418402E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1410    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2700393977E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418402E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1411    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1530354787E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418417E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1412    0.2456681074E-07    0.1843404330E-02    0.8064785703E-02    0.5780243075E-01    0.2477553235E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418404E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1413    0.2456681063E-07    0.1843404330E-02    0.8064785686E-02    0.5780243075E-01    0.2061494159E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418405E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1414    0.2456681060E-07    0.1843404330E-02    0.8064785681E-02    0.5780243075E-01    0.7116424008E-13        15     3
 intlbfgs> Mean deviation     0.1668418405E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418405E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1415    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3142852933E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418406E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1416    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.5987167654E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418406E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1417    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.9940758370E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1418    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.5590643979E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1419    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1141970534E-13        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1420    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.1340218736E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1421    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2620742185E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1422    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.5804931822E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1423    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.3411318482E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1424    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1137129364E-14        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1425    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.9948254340E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1426    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.7259197494E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1427    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1924533775E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1428    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.2870139072E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1429    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.2529088281E-14        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1430    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.6904244374E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1431    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3842343802E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1432    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1226412411E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418420E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1433    0.2456681004E-07    0.1843404330E-02    0.8064785589E-02    0.5780243075E-01    0.3903005494E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1434    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3922643407E-12        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418410E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1435    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1131908314E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1436    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.8053332000E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1437    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.1668160399E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1438    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1755526613E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1439    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1552591199E-14        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1440    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2356733559E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1441    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.3835733978E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1442    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.2167353278E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1443    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.7610207113E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1444    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.5176140264E-15        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1445    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2691322850E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1446    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2757958745E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1447    0.2456681060E-07    0.1843404330E-02    0.8064785681E-02    0.5780243075E-01    0.2253141367E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1448    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.2263686318E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1449    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2765944834E-14        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1450    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4309761640E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1451    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.6397267553E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1452    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.7241354354E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1453    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.9104962537E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1454    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2903884605E-15        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1455    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2801785805E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1456    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2366115269E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1457    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3318953057E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1458    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.9361446288E-16        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418407E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1459    0.2456681054E-07    0.1843404330E-02    0.8064785671E-02    0.5780243075E-01    0.1191236800E-12        15     3
 intlbfgs> Mean deviation     0.1668418407E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418408E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1460    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1145176888E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418437E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1461    0.2456681056E-07    0.1843404330E-02    0.8064785675E-02    0.5780243075E-01    0.8539407643E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1462    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.8379306893E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1463    0.2456681062E-07    0.1843404330E-02    0.8064785685E-02    0.5780243075E-01    0.9463732942E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1464    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4769463748E-15        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1465    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1757077739E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1466    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.7090664777E-16        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418413E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1467    0.2456681067E-07    0.1843404330E-02    0.8064785692E-02    0.5780243075E-01    0.1899458519E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1468    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1896787701E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1469    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1702359448E-15        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1470    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3573676305E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1471    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2104700936E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1472    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3130411857E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1473    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1745821440E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1474    0.2456681066E-07    0.1843404330E-02    0.8064785691E-02    0.5780243075E-01    0.2649543298E-13        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1475    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2625768795E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1476    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1950686740E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1477    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1066171532E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418443E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1478    0.2456681123E-07    0.1843404330E-02    0.8064785784E-02    0.5780243074E-01    0.1485610234E-11        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1479    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1485612880E-11        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1480    0.2456681062E-07    0.1843404330E-02    0.8064785685E-02    0.5780243075E-01    0.2098521628E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1481    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1948709054E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1482    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.6616551395E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1483    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2754666251E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418413E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1484    0.2456681310E-07    0.1843404330E-02    0.8064786092E-02    0.5780243075E-01    0.3860885569E-12        15     3
 intlbfgs> Mean deviation     0.1668418413E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1485    0.2456681057E-07    0.1843404330E-02    0.8064785675E-02    0.5780243075E-01    0.3787034551E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418412E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1486    0.2456681347E-07    0.1843404330E-02    0.8064786153E-02    0.5780243075E-01    0.2290577483E-11        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1487    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2253404137E-11        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1488    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.8462918319E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1489    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2161820243E-15        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1490    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4110742997E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1491    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4676499408E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1492    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4461714822E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1493    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3417359257E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1494    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.6044001786E-15        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1495    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4591919255E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1496    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2541866796E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1497    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1784755693E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1498    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.7781998304E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1499    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.5611602719E-15        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 checkrep> number of active repulsions and total=      56      56
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1500    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.5477343837E-14        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1501    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4758956222E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1502    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3127576926E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1503    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2702788287E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418411E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1504    0.2456681069E-07    0.1843404330E-02    0.8064785696E-02    0.5780243075E-01    0.1644492171E-12        15     3
 intlbfgs> Mean deviation     0.1668418411E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1505    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1606027656E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1506    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.1831175857E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1507    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1516175519E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1508    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.6881810754E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1509    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4368371515E-14        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1510    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.2629211468E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1511    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2219383530E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1512    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.6823331060E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418413E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1513    0.2456681137E-07    0.1843404330E-02    0.8064785808E-02    0.5780243075E-01    0.2574326981E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1514    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2571971607E-12        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1515    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2929854411E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1516    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1140359597E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1517    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2769631005E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1518    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2455129121E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1519    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2192059175E-14        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1520    0.2456681092E-07    0.1843404330E-02    0.8064785733E-02    0.5780243075E-01    0.7714854557E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1521    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.7692928491E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1522    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1362311852E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1523    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.5103129883E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1524    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.8838828752E-15        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1525    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.6510961318E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1526    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1034990124E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418424E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1527    0.2456681643E-07    0.1843404330E-02    0.8064786637E-02    0.5780243074E-01    0.1806566662E-11        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1528    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1806454785E-11        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1529    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4508300979E-15        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1530    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3000194919E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1531    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4155533853E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1532    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3562475694E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1533    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.9420944146E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1534    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4544093006E-15        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1535    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2181181440E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1536    0.2456681063E-07    0.1843404330E-02    0.8064785686E-02    0.5780243075E-01    0.1329001435E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1537    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1254331649E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1538    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.7481613613E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1539    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3814695624E-15        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418410E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1540    0.2456681069E-07    0.1843404330E-02    0.8064785696E-02    0.5780243075E-01    0.2791727918E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1541    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2797095450E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1542    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3339162570E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1543    0.2456681077E-07    0.1843404330E-02    0.8064785709E-02    0.5780243075E-01    0.4049089794E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1544    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4036994408E-13        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1545    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.7839866723E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1546    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.5521089461E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1547    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.4017454214E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1548    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2818608399E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1549    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1654364148E-14        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1550    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.9555861928E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1551    0.2456681075E-07    0.1843404330E-02    0.8064785705E-02    0.5780243075E-01    0.5899454991E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1552    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.5877308300E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1553    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3463261019E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1554    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1914696226E-15        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1555    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.7447214696E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1556    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.4362528484E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1557    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1437762019E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1558    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1071400985E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1559    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4599680863E-15        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1560    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2184003735E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1561    0.2456681142E-07    0.1843404330E-02    0.8064785816E-02    0.5780243075E-01    0.2381733644E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1562    0.2456681060E-07    0.1843404330E-02    0.8064785681E-02    0.5780243075E-01    0.2380604425E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1563    0.2456681151E-07    0.1843404330E-02    0.8064785831E-02    0.5780243075E-01    0.3593460117E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1564    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3528085073E-12        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1565    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1375944256E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1566    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2810917105E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418410E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1567    0.2456681050E-07    0.1843404330E-02    0.8064785665E-02    0.5780243075E-01    0.1623929306E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1568    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1632590908E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1569    0.2456681060E-07    0.1843404330E-02    0.8064785681E-02    0.5780243075E-01    0.1746664338E-13        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1570    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1505326165E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1571    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.6715309447E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1572    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3107516053E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1573    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1625397450E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418410E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1574    0.2456681004E-07    0.1843404330E-02    0.8064785589E-02    0.5780243075E-01    0.2348631210E-12        15     3
 intlbfgs> Mean deviation     0.1668418410E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1575    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2353476557E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1576    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.9212237578E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1577    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1389100126E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1578    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.8234792573E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1579    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2992710877E-15        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1580    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1397560683E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1581    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.5461130430E-16        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418413E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1582    0.2456681072E-07    0.1843404330E-02    0.8064785700E-02    0.5780243075E-01    0.4639672982E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1583    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4647569801E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1584    0.2456681055E-07    0.1843404330E-02    0.8064785673E-02    0.5780243075E-01    0.1512097457E-12        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1585    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.1466496132E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1586    0.2456681062E-07    0.1843404330E-02    0.8064785685E-02    0.5780243075E-01    0.1352109880E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1587    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.7155016088E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1588    0.2456681060E-07    0.1843404330E-02    0.8064785681E-02    0.5780243075E-01    0.1481395195E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1589    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1166341412E-14        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1590    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1010956186E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1591    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.5194222660E-16        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418407E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1592    0.2456681062E-07    0.1843404330E-02    0.8064785685E-02    0.5780243075E-01    0.2613070991E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1593    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2609655086E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1594    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.2775369066E-14        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1595    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2068737652E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1596    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.5494150899E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1597    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2530355173E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1598    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2171430802E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1599    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1365908068E-15        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 checkrep> number of active repulsions and total=      56      56
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1600    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.5867913504E-16        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1601    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.1525314461E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1602    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1358662716E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1603    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2212794710E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1604    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1015320384E-15        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1605    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.5086078340E-16        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418411E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1606    0.2456681145E-07    0.1843404330E-02    0.8064785820E-02    0.5780243075E-01    0.1533428166E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1607    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1531836238E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1608    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1846236031E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418407E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1609    0.2456681103E-07    0.1843404330E-02    0.8064785751E-02    0.5780243075E-01    0.2469418588E-12        15     3
 intlbfgs> Mean deviation     0.1668418407E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1610    0.2456681061E-07    0.1843404330E-02    0.8064785682E-02    0.5780243075E-01    0.2480030037E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418407E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1611    0.2456681091E-07    0.1843404330E-02    0.8064785732E-02    0.5780243075E-01    0.2625557382E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1612    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2561483975E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1613    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3228142712E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1614    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.6400517061E-15        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1615    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3491453191E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418410E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1616    0.2456681147E-07    0.1843404330E-02    0.8064785823E-02    0.5780243075E-01    0.1952345034E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1617    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1945654277E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1618    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1868970761E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1619    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1787721725E-13        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1620    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2824440301E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1621    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1279397740E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418412E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1622    0.2456681003E-07    0.1843404330E-02    0.8064785587E-02    0.5780243075E-01    0.5374896639E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1623    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.5370749091E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1624    0.2456681060E-07    0.1843404330E-02    0.8064785681E-02    0.5780243075E-01    0.3150955445E-14        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1625    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2636247487E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1626    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2500317748E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1627    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2756734687E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418410E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1628    0.2456681142E-07    0.1843404330E-02    0.8064785815E-02    0.5780243075E-01    0.1412800319E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1629    0.2456681062E-07    0.1843404330E-02    0.8064785685E-02    0.5780243075E-01    0.1398126296E-12        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1630    0.2456681057E-07    0.1843404330E-02    0.8064785677E-02    0.5780243075E-01    0.4480842011E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1631    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4109061944E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1632    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2978506309E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1633    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4446798803E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1634    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.5017900502E-15        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1635    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4232565720E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1636    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4297329287E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418411E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1637    0.2456681113E-07    0.1843404330E-02    0.8064785769E-02    0.5780243075E-01    0.2209486946E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1638    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2200662622E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1639    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.3158245060E-14        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1640    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2817094273E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1641    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1232880951E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1642    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4202102586E-16        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418413E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1643    0.2456681064E-07    0.1843404330E-02    0.8064785688E-02    0.5780243074E-01    0.6534836822E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1644    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.6535677679E-12        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1645    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4506039864E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1646    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2290333133E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1647    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1164428923E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1648    0.2456681070E-07    0.1843404330E-02    0.8064785697E-02    0.5780243075E-01    0.2630374110E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1649    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2566405551E-13        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1650    0.2456681066E-07    0.1843404330E-02    0.8064785691E-02    0.5780243075E-01    0.1754917253E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1651    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1635815600E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1652    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2724413102E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1653    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1670529130E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1654    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.6882116395E-15        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1655    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.5081889523E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1656    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2578354930E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1657    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4918947428E-16        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418425E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1658    0.2456682375E-07    0.1843404330E-02    0.8064787840E-02    0.5780243074E-01    0.1654984607E-11        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1659    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1654773229E-11        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1660    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.9297153345E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1661    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3821907286E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418411E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1662    0.2456681061E-07    0.1843404330E-02    0.8064785682E-02    0.5780243075E-01    0.7202277750E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1663    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.7168948395E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1664    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.5256674581E-15        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1665    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3189446174E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1666    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2146946044E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1667    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.7710129349E-16        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418417E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1668    0.2456681411E-07    0.1843404330E-02    0.8064786258E-02    0.5780243075E-01    0.1407596423E-11        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1669    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1407807174E-11        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1670    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3760973798E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1671    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.9123454655E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1672    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3478333326E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418412E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1673    0.2456681048E-07    0.1843404330E-02    0.8064785662E-02    0.5780243075E-01    0.1655299082E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1674    0.2456681063E-07    0.1843404330E-02    0.8064785685E-02    0.5780243075E-01    0.1637254687E-12        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418411E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1675    0.2456681048E-07    0.1843404330E-02    0.8064785662E-02    0.5780243075E-01    0.1173562396E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1676    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1096822624E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1677    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3548201224E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418413E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1678    0.2456681110E-07    0.1843404330E-02    0.8064785763E-02    0.5780243075E-01    0.5224456520E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1679    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.5259781563E-12        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418410E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1680    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.3399696170E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1681    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.2932368222E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1682    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.5803745615E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1683    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.3985171263E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1684    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3345668796E-14        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1685    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2687479035E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1686    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1597664646E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1687    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.6767111339E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418411E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1688    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1083402696E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1689    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1054658152E-12        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1690    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3659954246E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1691    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1263579982E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1692    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3279609707E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1693    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1831125199E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1694    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1155664411E-14        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1695    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1720465024E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418412E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1696    0.2456681125E-07    0.1843404330E-02    0.8064785788E-02    0.5780243075E-01    0.2798991191E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1697    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2797935197E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1698    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1131350794E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1699    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4604418506E-15        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 checkrep> number of active repulsions and total=      56      56
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1700    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.9371954120E-15        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1701    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4657386815E-15        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1702    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.9984232145E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1703    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2540721156E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1704    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3219150142E-15        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1705    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4644099158E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1706    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2489747777E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418410E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1707    0.2456681025E-07    0.1843404330E-02    0.8064785624E-02    0.5780243075E-01    0.9501637502E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1708    0.2456681062E-07    0.1843404330E-02    0.8064785685E-02    0.5780243075E-01    0.9368537468E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418410E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1709    0.2456681059E-07    0.1843404330E-02    0.8064785679E-02    0.5780243075E-01    0.5763914672E-13        15     3
 intlbfgs> Mean deviation     0.1668418410E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1710    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.5229151018E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1711    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.7720788908E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1712    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.8982691199E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1713    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.5842409955E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1714    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1933185713E-15        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418412E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1715    0.2456680827E-07    0.1843404330E-02    0.8064785299E-02    0.5780243075E-01    0.3867563570E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1716    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3855414879E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418410E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1717    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4553462170E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1718    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3972191674E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1719    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3709458669E-15        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1720    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2890620498E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418413E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1721    0.2456681160E-07    0.1843404330E-02    0.8064785844E-02    0.5780243075E-01    0.6160458137E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1722    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.6158837380E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1723    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4192283989E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1724    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3427626963E-14        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418410E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1725    0.2456681058E-07    0.1843404330E-02    0.8064785678E-02    0.5780243075E-01    0.4720642994E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1726    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4714888618E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1727    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.7099461443E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1728    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2917225468E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1729    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1075136987E-14        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1730    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.7385877637E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1731    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.7750318946E-16        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418410E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1732    0.2456681136E-07    0.1843404330E-02    0.8064785805E-02    0.5780243075E-01    0.2973874926E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1733    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.2972546623E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418408E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1734    0.2456681066E-07    0.1843404330E-02    0.8064785691E-02    0.5780243075E-01    0.3633196842E-13        15     3
 intlbfgs> Mean deviation     0.1668418408E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1735    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3401420168E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1736    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.1797573136E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1737    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3731794240E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1738    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3248969018E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1739    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.5036238970E-15        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1740    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.2439309824E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418411E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1741    0.2456681267E-07    0.1843404330E-02    0.8064786020E-02    0.5780243075E-01    0.3009122825E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1742    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3002678486E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418417E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1743    0.2456681058E-07    0.1843404330E-02    0.8064785678E-02    0.5780243075E-01    0.3016825432E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1744    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2934388208E-12        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1745    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.3139808933E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418488E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1746    0.2456681069E-07    0.1843404330E-02    0.8064785696E-02    0.5780243075E-01    0.3702174931E-11        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1747    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3701678926E-11        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1748    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2254440533E-15        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418406E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1749    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1624087365E-12        15     3
 intlbfgs> Mean deviation     0.1668418406E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1750    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.1622117843E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1751    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2863436130E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1752    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.8790431037E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1753    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.7078840853E-16        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418424E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1754    0.2456678284E-07    0.1843404330E-02    0.8064781124E-02    0.5780243074E-01    0.6057387224E-11        15     3
 intlbfgs> Mean deviation     0.1668418424E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1755    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.6056114435E-11        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418422E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1756    0.2456681078E-07    0.1843404330E-02    0.8064785711E-02    0.5780243075E-01    0.6516849620E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1757    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.6392355312E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1758    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.5002861734E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1759    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.1520895071E-15        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418424E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1760    0.2456683790E-07    0.1843404330E-02    0.8064790162E-02    0.5780243074E-01    0.3271000537E-11        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1761    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3270621532E-11        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1762    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.5128957824E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1763    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.6287017199E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1764    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.5369314847E-14        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1765    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.1715580650E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1766    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.6205498239E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1767    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4209750118E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1768    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.1805666544E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1769    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3863454451E-14        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1770    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2764475047E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1771    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.9015919510E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1772    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.9411955684E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1773    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2361243952E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1774    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1600900940E-14        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1775    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1249206523E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1776    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1097954021E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1777    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.8175199035E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1778    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4224357446E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418410E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1779    0.2456681009E-07    0.1843404330E-02    0.8064785597E-02    0.5780243075E-01    0.6337279942E-12        15     3
 intlbfgs> Mean deviation     0.1668418410E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1780    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.6335816240E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1781    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.9899563702E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1782    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1842129576E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1783    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1470041887E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1784    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.7386117028E-15        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1785    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2734467990E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1786    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2178020954E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1787    0.2456680816E-07    0.1843404330E-02    0.8064785281E-02    0.5780243075E-01    0.2987625683E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1788    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2989045328E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1789    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3136892604E-14        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1790    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2895443550E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1791    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.6462978794E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418411E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1792    0.2456681138E-07    0.1843404330E-02    0.8064785810E-02    0.5780243075E-01    0.1269819102E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1793    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.1268576779E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1794    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.8597368462E-14        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1795    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.6302171927E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1796    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.4015819394E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1797    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.1872129988E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1798    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.5188841055E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1799    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3750715180E-14        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 checkrep> number of active repulsions and total=      56      56
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1800    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.6274740055E-14        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1801    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4338903563E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1802    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2307051281E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1803    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1440752691E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1804    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4346716786E-15        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1805    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.5406656080E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1806    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1042868086E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418418E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1807    0.2456681522E-07    0.1843404330E-02    0.8064786439E-02    0.5780243075E-01    0.6233542873E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1808    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.6229006582E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1809    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1806530130E-13        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1810    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1467005463E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1811    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3957538086E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1812    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1780441876E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1813    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4219496722E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1814    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2776559227E-14        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1815    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2610684805E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1816    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1620272691E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1817    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3574249816E-16        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418711E-02
 intlbfgs> Highest QCI image energy=    0.2743978789E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978789E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1818    0.2456713015E-07    0.1843404331E-02    0.8064838137E-02    0.5780243070E-01    0.4292448883E-10        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1819    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4292421773E-10        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1820    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3736800187E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1821    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1437562408E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1822    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1703498899E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1823    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2691154750E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1824    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2672979358E-14        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1825    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1574403292E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418417E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1826    0.2456681403E-07    0.1843404330E-02    0.8064786244E-02    0.5780243075E-01    0.6582743185E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1827    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.6581802573E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1828    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4252356260E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1829    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2953794519E-15        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1830    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1297912568E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1831    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3048181693E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1832    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1826406260E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1833    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.9863348948E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1834    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.5107378580E-15        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1835    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2717693833E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1836    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2276653252E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1837    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4332512671E-16        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1838    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.5301758652E-16        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418411E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1839    0.2456681198E-07    0.1843404330E-02    0.8064785907E-02    0.5780243075E-01    0.1580722915E-12        15     3
 intlbfgs> Mean deviation     0.1668418411E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1840    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.1577900072E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418411E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1841    0.2456681073E-07    0.1843404330E-02    0.8064785703E-02    0.5780243075E-01    0.1068347366E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1842    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1022251380E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1843    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1020129607E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1844    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.3675768621E-14        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1845    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2991712654E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1846    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.6369506409E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1847    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1264256239E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1848    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.5268230470E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1849    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2755341591E-15        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1850    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1524165414E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1851    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3520523826E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1852    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3723430382E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1853    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3358462500E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1854    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1891022452E-15        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418410E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1855    0.2456681096E-07    0.1843404330E-02    0.8064785740E-02    0.5780243075E-01    0.7556978537E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1856    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.7497289832E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418410E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1857    0.2456681064E-07    0.1843404330E-02    0.8064785687E-02    0.5780243075E-01    0.3392394065E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1858    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3050939950E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1859    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.5550018907E-15        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1860    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.7640932169E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1861    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1791069082E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1862    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1252505371E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1863    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.4307666932E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1864    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.5937849476E-15        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1865    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.6269370752E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1866    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.1000886924E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418428E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1867    0.2456681979E-07    0.1843404330E-02    0.8064787189E-02    0.5780243075E-01    0.9490232207E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1868    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.9486922398E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1869    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1971419292E-14        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1870    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1628341806E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1871    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3195018029E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1872    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.9008851234E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1873    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1317591886E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418414E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1874    0.2456681002E-07    0.1843404330E-02    0.8064785585E-02    0.5780243075E-01    0.2162209538E-12        15     3
 intlbfgs> Mean deviation     0.1668418414E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1875    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.2159687119E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1876    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1863388340E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1877    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.9076390201E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1878    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2362379093E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1879    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3259087861E-15        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1880    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1812742369E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1881    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.7832367351E-16        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418410E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1882    0.2456681112E-07    0.1843404330E-02    0.8064785766E-02    0.5780243075E-01    0.8670537108E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1883    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.8574726503E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1884    0.2456681062E-07    0.1843404330E-02    0.8064785685E-02    0.5780243075E-01    0.1146678708E-13        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1885    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.9998814795E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1886    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3263044050E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1887    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2806625027E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418415E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1888    0.2456681166E-07    0.1843404330E-02    0.8064785855E-02    0.5780243075E-01    0.2835479880E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1889    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2834915357E-12        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1890    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.5047779870E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1891    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1094139363E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1892    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1658178967E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418433E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1893    0.2456683007E-07    0.1843404330E-02    0.8064788876E-02    0.5780243074E-01    0.3203890082E-11        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1894    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3203308165E-11        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1895    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.7968163825E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1896    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.6441220513E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1897    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4579806737E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1898    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2947779665E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1899    0.2456680621E-07    0.1843404330E-02    0.8064784961E-02    0.5780243075E-01    0.3909462831E-12        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 checkrep> number of active repulsions and total=      56      56
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1900    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3908199663E-12        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1901    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1528540230E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1902    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.7633825930E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418411E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1903    0.2456681118E-07    0.1843404330E-02    0.8064785777E-02    0.5780243075E-01    0.1133788059E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1904    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1133142857E-12        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1905    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.9611904285E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1906    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.6341628007E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1907    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1160446976E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1908    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.8570589966E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1909    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.5830258190E-14        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1910    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3082965337E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418410E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1911    0.2456681062E-07    0.1843404330E-02    0.8064785685E-02    0.5780243075E-01    0.2868566931E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1912    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2638823078E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1913    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2250455860E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1914    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.7261993528E-15        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1915    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2637841958E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1916    0.2456681233E-07    0.1843404330E-02    0.8064785965E-02    0.5780243075E-01    0.6390358886E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1917    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.6389116862E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1918    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.8984143432E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1919    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.8134734200E-14        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1920    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.6154147058E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418414E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1921    0.2456681203E-07    0.1843404330E-02    0.8064785916E-02    0.5780243075E-01    0.2960106718E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1922    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2958634235E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1923    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1160096652E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1924    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.5967918923E-15        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1925    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.7362904173E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1926    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.6190455910E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1927    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.8829395166E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1928    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3248404775E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1929    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1191627056E-15        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418392E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1930    0.2456681173E-07    0.1843404330E-02    0.8064785867E-02    0.5780243075E-01    0.1440989422E-11        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1931    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1444037912E-11        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1932    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1274958776E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1933    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1104949730E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1934    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1552428272E-14        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1935    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1132110947E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1936    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.5195059043E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1937    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4746412013E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418410E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1938    0.2456681152E-07    0.1843404330E-02    0.8064785831E-02    0.5780243075E-01    0.1943664016E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1939    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1941203621E-12        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1940    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.5449092094E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1941    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.2342933148E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1942    0.2456681219E-07    0.1843404330E-02    0.8064785943E-02    0.5780243075E-01    0.2715802167E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1943    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2711039296E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418410E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1944    0.2456681061E-07    0.1843404330E-02    0.8064785682E-02    0.5780243075E-01    0.2042690841E-13        15     3
 intlbfgs> Mean deviation     0.1668418410E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1945    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.1497796046E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1946    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4178226243E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1947    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3164557650E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1948    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1071981619E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1949    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2306856604E-14        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1950    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1841235216E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418410E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1951    0.2456681104E-07    0.1843404330E-02    0.8064785754E-02    0.5780243075E-01    0.7426072082E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1952    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.7437248617E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1953    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2899783086E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1954    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1232982900E-14        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1955    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1273069142E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1956    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.8346362844E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1957    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.9644018720E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1958    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1085274517E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1959    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.1884175680E-14        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1960    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4742475639E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1961    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1754305036E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1962    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.7964468604E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1963    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.8166576909E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1964    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4969756864E-15        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1965    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.8064658852E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1966    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1350479459E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1967    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.7227445728E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1968    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3134701120E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1969    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.8868048645E-16        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418412E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1970    0.2456681221E-07    0.1843404330E-02    0.8064785946E-02    0.5780243075E-01    0.2123007808E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1971    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2122253030E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418410E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1972    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.2089387508E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1973    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1804827738E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1974    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1836040274E-14        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1975    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4173362650E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1976    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3193340829E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418417E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1977    0.2456681317E-07    0.1843404330E-02    0.8064786102E-02    0.5780243075E-01    0.4737273412E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1978    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4734500320E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1979    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3064188818E-14        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1980    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.4370019082E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1981    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2533786348E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1982    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.6937423509E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418401E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1983    0.2456681602E-07    0.1843404330E-02    0.8064786571E-02    0.5780243075E-01    0.1529888550E-11        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1984    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1529711900E-11        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1985    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3543019651E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1986    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.9936651822E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1987    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.7343780223E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1988    0.2456681083E-07    0.1843404330E-02    0.8064785719E-02    0.5780243075E-01    0.4778462560E-12        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1989    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4776993184E-12        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1990    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.3053000501E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1991    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.5058607946E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1992    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3115626937E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1993    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.8040543772E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1994    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.5578211338E-15        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1995    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1012140822E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1996    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.5908941787E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1997    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2134170794E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1998    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.2017372933E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1999    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.1262073717E-14        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 checkrep> number of active repulsions and total=      56      56
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2000    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.1634483691E-15        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2001    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1090352291E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2002    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2546093415E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2003    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.5156349482E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418410E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2004    0.2456681057E-07    0.1843404330E-02    0.8064785676E-02    0.5780243075E-01    0.8030125871E-13        15     3
 intlbfgs> Mean deviation     0.1668418410E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2005    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.8017295947E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2006    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3949335911E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2007    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3859514032E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2008    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.5920176598E-15        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418411E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2009    0.2456681067E-07    0.1843404330E-02    0.8064785692E-02    0.5780243075E-01    0.9058839755E-13        15     3
 intlbfgs> Mean deviation     0.1668418411E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2010    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.8926831087E-13        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2011    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.3414283039E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2012    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.1924641414E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2013    0.2456681061E-07    0.1843404330E-02    0.8064785683E-02    0.5780243075E-01    0.3346995221E-14        15     3
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2014    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.2192140998E-14        15     3
 intlbfgs> Mean deviation     0.1668418409E-02 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.6197465653     for atom     10 and images      1     2 total images=     1
 congrad> Highest constraint for image      2 con     43 atoms      9    14 value=    0.24567E-07 d,ref,cutoff=     1.5688         1.6201        0.51284E-01 max grad=    0.80648E-02
 congrad> Highest repulsion  for image      2 ind     55 atoms     14    10 value=    0.18434E-02 d,cutoff=     2.8032         2.8733     max grad=    0.57802E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.8823288361        0.1668418409E-02
 intlbfgs> Highest QCI image energy=    0.2743978790E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2743978790E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2015    0.2456681062E-07    0.1843404330E-02    0.8064785684E-02    0.5780243075E-01    0.4370407622E-15        15     3
 intlbfgs> energies for images:
     1        0.0000000000
     2        0.0027439788
     3        0.0000000000
 intlbfgs> After   2015 steps, energy/image=    0.2743978790E-02 RMS= 0.36509793E-13 images=   1
 intlbfgs> WORST=    0.2743978790E-02
 intlbfgs> retaining        1 QCI images, highest energy=    0.2743978790E-02
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 tryconnect> Number of proposed DNEB images        3 exceeds number from QCI. Redistributing.
 imageredistribution2> total distance=     1.764657672     regular spacing     0.4411644180    
 imageredistribution2> placing image      2 at image      1 energy     -273.6072722    
 imageredistribution2> placing image      3 at image      2 energy     -273.6024515    
 imageredistribution2> placing image      4 at image      2 energy     -273.6024515    
 imageredistribution2> new distances:
       1     0.000000000    
       2     0.000000000    
       3    0.8823141151    
       4    0.8823141151    
       5     1.764657672    
 tryconnect> 45-iteration DNEB run for      3 images with RMS convergence condition     0.1000000000E-03 newneb> Number of atoms or variables =           15
 KeyNEB> Initial and final NEB force constants     10.00000000        10.00000000     factor=    1.000000000    
 KeyNEB> Using 3 images
 KeyNEB> NEB coordinates will be saved to xyz file "neb.xyz" every 100 iterations
 KeyNEB> Energy profile will be saved to file "neb.EofS" every 100 iterations
 KeyNEB> Verbose printing is on
 KeyNEB> Evolution of AvDev, E, Rms and S will be saved to files "AvDevofI", "EofI", "RmsofI" and "SofI"
 rwg> NEB coordinates were saved to xyz file "neb.0.xyz"
                  Iter   Energy per image      RMS Force       Av.Dev    Path     Step length/images      k(1)
tangent vector problem for image        2 WMINUS and WPLUS=    0.6712870859E-02    0.1379589776E-09 EM=    -273.6072722    
 writeprofile> NEB profile was saved to file "neb.EofS.0"
 nebbfgs> steps:      1    -273.6042724        0.3551240149       32.10%  1.76             0.11543            10.000    
 nebbfgs> steps:      2    -273.6044868        0.1546438045       24.68%  1.76             0.46428E-01        10.000    
 nebbfgs> steps:      3    -273.6046587        0.1358916690       19.27%  1.76             0.29624E-01        10.000    
 nebbfgs> steps:      4    -273.6053879        0.4949476776E-01    2.50%  1.76             0.66300E-01        10.000    
 nebbfgs> steps:      5    -273.6052157        0.9653239152E-01    0.90%  1.77             0.17609E-01        10.000    
 nebbfgs> steps:      6    -273.6054976        0.1480477142E-01    0.26%  1.76             0.10996E-01        10.000    
 nebbfgs> steps:      7    -273.6055860        0.1338987347E-01    0.16%  1.77             0.23077E-02        10.000    
 nebbfgs> steps:      8    -273.6056429        0.8980699784E-02    0.04%  1.77             0.87920E-03        10.000    
 nebbfgs> steps:      9    -273.6059165        0.1490521440E-01    0.36%  1.77             0.35879E-02        10.000    
 nebbfgs> steps:     10    -273.6061086        0.1562860858E-01    0.36%  1.77             0.26665E-02        10.000    
 nebbfgs> steps:     11    -273.6071953        0.9657828424E-01    0.39%  1.78             0.28232E-01        10.000    
 nebbfgs> steps:     12    -273.6062498        0.8759745262E-02    0.04%  1.77             0.25848E-01        10.000    
 nebbfgs> steps:     13    -273.6063673        0.7645099964E-02    0.04%  1.77             0.21272E-02        10.000    
 nebbfgs> steps:     14    -273.6067700        0.2479363384E-01    0.12%  1.77             0.80678E-02        10.000    
 nebbfgs> steps:     15    -273.6068804        0.1748936968E-01    0.11%  1.77             0.28245E-02        10.000    
 nebbfgs> steps:     16    -273.6076473        0.1267101358        0.19%  1.80             0.36047E-01        10.000    
 nebbfgs> steps:     17    -273.6068763        0.4725384463E-01    0.08%  1.77             0.33928E-01        10.000    
 nebbfgs> steps:     18    -273.6062185        0.8994630888E-01    0.21%  1.77             0.16097E-01        10.000    
 nebbfgs> steps:     19    -273.6057119        0.6380624900E-01    0.13%  1.77             0.10399E-01        10.000    
 nebbfgs> Decreasing DNEB force constant to      9.708737864    
 nebbfgs> steps:     20    -273.6051203        0.6447585724E-01    0.13%  1.77             0.14779E-01        9.7087    
 nebbfgs> steps:     21    -273.6050439        0.2619389930E-01    0.13%  1.76             0.57249E-02        9.7087    
 nebbfgs> steps:     22    -273.6054125        0.3058884214E-01    0.08%  1.76             0.59188E-02        9.7087    
 nebbfgs> steps:     23    -273.6053389        0.1020326474E-01    0.08%  1.76             0.25654E-02        9.7087    
 nebbfgs> steps:     24    -273.6054933        0.8926577210E-02    0.07%  1.76             0.15892E-02        9.7087    
 nebbfgs> steps:     25    -273.6066392        0.5589249171E-01    0.14%  1.77             0.18025E-01        9.7087    
 nebbfgs> steps:     26    -273.6058673        0.8366097050E-02    0.04%  1.77             0.13865E-01        9.7087    
 nebbfgs> steps:     27    -273.6060835        0.7700369126E-02    0.02%  1.77             0.28535E-02        9.7087    
 nebbfgs> steps:     28    -273.6053663        0.1759916906        0.80%  1.83             0.71384E-01        9.7087    
 nebbfgs> steps:     29    -273.6062970        0.1022470544E-01    0.06%  1.77             0.68358E-01        9.7087    
 nebbfgs> steps:     30    -273.6064162        0.3585406441E-01    0.02%  1.77             0.38755E-02        9.7087    
 nebbfgs> steps:     31    -273.6063926        0.6576955201E-02    0.03%  1.77             0.24718E-02        9.7087    
 nebbfgs> steps:     32    -273.6064887        0.1126883535E-01    0.04%  1.77             0.17157E-02        9.7087    
 nebbfgs> steps:     33    -273.6067544        0.1927863227E-01    0.06%  1.77             0.52379E-02        9.7087    
 nebbfgs> steps:     34    -273.6073048        0.6204183591E-01    0.12%  1.78             0.16017E-01        9.7087    
 nebbfgs> steps:     35    -273.6069699        0.1228982276E-01    0.04%  1.77             0.10626E-01        9.7087    
 nebbfgs> steps:     36    -273.6070524        0.8302233579E-02    0.03%  1.78             0.24186E-02        9.7087    
 nebbfgs> steps:     37    -273.6075136        0.5934876513E-01    0.07%  1.79             0.16584E-01        9.7087    
 nebbfgs> steps:     38    -273.6071990        0.7453784247E-02    0.02%  1.78             0.11766E-01        9.7087    
 nebbfgs> steps:     39    -273.6072504        0.7657691836E-02    0.01%  1.78             0.17846E-02        9.7087    
 nebbfgs> Decreasing DNEB force constant to      9.425959091    
 nebbfgs> steps:     40    -273.6074023        0.1795572537E-01    0.04%  1.78             0.55638E-02        9.4260    
 nebbfgs> steps:     41    -273.6075338        0.1673411053E-01    0.08%  1.79             0.54129E-02        9.4260    
 Search direction has positive projection onto gradient - reversing step
 nebbfgs> steps:     42    -273.6077104        0.2286093020        2.41%  1.89             0.91942E-01        9.4260    
 nebbfgs> steps:     43    -273.6075496        0.4538008361E-01    0.12%  1.79             0.90881E-01        9.4260    
 nebbfgs> steps:     44    -273.6070620        0.9785099365E-01    0.29%  1.78             0.11574E-01        9.4260    
 nebbfgs> steps:     45    -273.5987398        0.2331297006        1.65%  1.79             0.52806E-01        9.4260    
 nebbfgs> Final DNEB force constant      9.425959091    
 newneb> mean image separation is       0.4481
 writeprofile> NEB profile was saved to file "neb.EofS"
 rwg> NEB coordinates were saved to xyz file "neb.xyz"
 Time to go through NEB:   0.34880300000000020     
 Reached maximal number of iterations limit.
 time= 0.35 sec (0.01 sec/iteration)
 Following    1 images are candidates for TS:    1  
 Index of first candidate is            2
 bfgsts> resetting maximum uphill step size to     0.2000000000E-01

 BFGSTS> Beginning of optimization cycle    1.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=    0.23265E-01    0.23450E-01    0.23080E-01  -273.596209730      -273.596196918      -273.596203336     0.137    
predicted gradient component=   -0.6406040484E-02
xmylbfgs> Eigenvalue and RMS=    0.2344956139E-01    0.1371265880     after      0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.27048E-01   -0.27076E-01   -0.27020E-01  -273.596200485      -273.596206213      -273.596203336     0.446E-01
predicted gradient component=    0.2864064982E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.2707617628E-01   0.4455521238E-01    186.6058824     after      1 steps, step: 0.0846166551
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.34634E-01   -0.34621E-01   -0.34647E-01  -273.596199087      -273.596207619      -273.596203336     0.188E-01
predicted gradient component=    0.4266167991E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.3462117414E-01   0.1876022659E-01    21.79301553     after      2 steps, step: 0.0454688073
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.37016E-01   -0.36981E-01   -0.37051E-01  -273.596198860      -273.596207848      -273.596203336     0.182E-01
predicted gradient component=    0.4494088984E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.3698122862E-01   0.1820423480E-01    6.381763300     after      3 steps, step: 0.0233283941
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.43529E-01   -0.43731E-01   -0.43327E-01  -273.596201586      -273.596205129      -273.596203336     0.201E-01
predicted gradient component=    0.1771335491E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.4373108723E-01   0.2006337534E-01    15.43492064     after      4 steps, step: 0.1000000000
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.48188E-01   -0.48144E-01   -0.48232E-01  -273.596200211      -273.596206509      -273.596203336     0.279E-01
predicted gradient component=    0.3148698994E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.4814355529E-01   0.2785750296E-01    9.165231028     after      5 steps, step: 0.1000000000
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.52704E-01   -0.52618E-01   -0.52790E-01  -273.596202462      -273.596204263      -273.596203336     0.200E-01
predicted gradient component=    0.9006289758E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.5261843773E-01   0.2000040515E-01    8.504400028     after      6 steps, step: 0.1000000000
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.57016E-01   -0.57124E-01   -0.56908E-01  -273.596203660      -273.596203069      -273.596203336     0.152E-01
predicted gradient component=   -0.2955210050E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.5712390338E-01   0.1520206315E-01    7.887180992     after      7 steps, step: 0.1000000000
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.61357E-01   -0.61280E-01   -0.61434E-01  -273.596204446      -273.596202287      -273.596203336     0.123E-01
predicted gradient component=   -0.1079837489E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.6128002640E-01   0.1227270733E-01    6.782182165     after      8 steps, step: 0.1000000000
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.64626E-01   -0.64670E-01   -0.64582E-01  -273.596204285      -273.596202451      -273.596203336     0.119E-01
predicted gradient component=   -0.9170750275E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.6466987042E-01   0.1192247106E-01    5.241767152     after      9 steps, step: 0.1000000000
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.66958E-01   -0.66991E-01   -0.66925E-01  -273.596204834      -273.596201905      -273.596203336     0.117E-01
predicted gradient component=   -0.1464215984E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.6699060866E-01   0.1170796723E-01    3.464274005     after     10 steps, step: 0.1000000000
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.68525E-01   -0.68441E-01   -0.68609E-01  -273.596204126      -273.596202614      -273.596203336     0.730E-02
predicted gradient component=   -0.7562104827E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.6844074644E-01   0.7298463628E-02    2.118822273     after     11 steps, step: 0.1000000000
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.68844E-01   -0.68931E-01   -0.68757E-01  -273.596203197      -273.596203543      -273.596203336     0.582E-02
predicted gradient component=    0.1729020198E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.6893057874E-01   0.5817315863E-02   0.7106168281     after     12 steps, step: 0.0283610714
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.69441E-01   -0.69522E-01   -0.69360E-01  -273.596202994      -273.596203747      -273.596203336     0.579E-02
predicted gradient component=    0.3767684973E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.6952245746E-01   0.5791672315E-02   0.8513489682     after     13 steps, step: 0.0320316162
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.70171E-01   -0.70191E-01   -0.70151E-01  -273.596201767      -273.596204975      -273.596203336     0.817E-02
predicted gradient component=    0.1604161497E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.7019061522E-01   0.8166795989E-02   0.9519189407     after     14 steps, step: 0.0554848948
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.70724E-01   -0.70741E-01   -0.70707E-01  -273.596202803      -273.596203940      -273.596203336     0.738E-02
predicted gradient component=    0.5684290159E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.7074091213E-01   0.7383045016E-02   0.7779047440     after     15 steps, step: 0.0505231516
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.70989E-01   -0.71198E-01   -0.70780E-01  -273.596202736      -273.596204007      -273.596203336     0.490E-02
predicted gradient component=    0.6355355140E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.7119758315E-01   0.4898634987E-02   0.6414136479     after     16 steps, step: 0.0355340702
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.71649E-01   -0.71683E-01   -0.71615E-01  -273.596202699      -273.596204045      -273.596203336     0.397E-02
predicted gradient component=    0.6731025053E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.7168279317E-01   0.3971110925E-02   0.6768849283     after     17 steps, step: 0.0606206548
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.71750E-01   -0.71797E-01   -0.71703E-01  -273.596202063      -273.596204681      -273.596203336     0.648E-02
predicted gradient component=    0.1309075003E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.7179711122E-01   0.6482997510E-02   0.1592237525     after     18 steps, step: 0.0388289253
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.71834E-01   -0.71953E-01   -0.71715E-01  -273.596202189      -273.596204554      -273.596203336     0.302E-02
predicted gradient component=    0.1182317988E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.7195297270E-01   0.3016077852E-02   0.2166157490     after     19 steps, step: 0.0113189014
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.71831E-01   -0.72054E-01   -0.71608E-01  -273.596202163      -273.596204581      -273.596203336     0.207E-02
predicted gradient component=    0.1209015494E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.7205421056E-01   0.2068312915E-02   0.1405023569     after     20 steps, step: 0.0123646463
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.72007E-01   -0.72123E-01   -0.71891E-01  -273.596202085      -273.596204658      -273.596203336     0.225E-02
predicted gradient component=    0.1286366484E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.7212327099E-01   0.2253460092E-02   0.9575333013E-01 after     21 steps, step: 0.0129248390
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.72003E-01   -0.72215E-01   -0.71791E-01  -273.596201989      -273.596204755      -273.596203336     0.191E-02
predicted gradient component=    0.1382861512E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.7221541399E-01   0.1911160086E-02   0.1275946324     after     22 steps, step: 0.0185705684
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.72150E-01   -0.72246E-01   -0.72054E-01  -273.596201932      -273.596204812      -273.596203336     0.342E-02
predicted gradient component=    0.1440360990E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.7224558766E-01   0.3422110810E-02   0.4176542846E-01 after     23 steps, step: 0.0246676890
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.72131E-01   -0.72299E-01   -0.71963E-01  -273.596201910      -273.596204833      -273.596203336     0.648E-03
predicted gradient component=    0.1461516490E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.7229861572E-01   0.6483166008E-03   0.7334587915E-01 after     24 steps, step: 0.0081133444
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.72049E-01   -0.72304E-01   -0.71794E-01  -273.596201914      -273.596204829      -273.596203336     0.526E-03
predicted gradient component=    0.1457437520E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.7230426479E-01   0.5258043517E-03   0.7812919948E-02 after     25 steps, step: 0.0034053732
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.72254E-01   -0.72319E-01   -0.72189E-01  -273.596201940      -273.596204804      -273.596203336     0.668E-03
predicted gradient component=    0.1432053978E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.7231946133E-01   0.6680335998E-03   0.2101306535E-01 after     26 steps, step: 0.0071430318
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.72239E-01   -0.72326E-01   -0.72152E-01  -273.596201819      -273.596204925      -273.596203336     0.186E-02
predicted gradient component=    0.1552766491E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.7232578790E-01   0.1862706903E-02   0.8747325112E-02 after     27 steps, step: 0.0195546191
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.72142E-01   -0.72345E-01   -0.71939E-01  -273.596201877      -273.596204867      -273.596203336     0.472E-03
predicted gradient component=    0.1494854985E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.7234478748E-01   0.4715128153E-03   0.2626254550E-01 after     28 steps, step: 0.0031578969
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.72212E-01   -0.72349E-01   -0.72076E-01  -273.596201876      -273.596204868      -273.596203336     0.355E-03
predicted gradient component=    0.1495713008E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.7234853530E-01   0.3549772962E-03   0.5180220672E-02 after     29 steps, step: 0.0033506795
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.72149E-01   -0.72353E-01   -0.71945E-01  -273.596201864      -273.596204879      -273.596203336     0.336E-03
predicted gradient component=    0.1507556505E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.7235277935E-01   0.3364809859E-03   0.5865770124E-02 after     30 steps, step: 0.0047860649
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.72164E-01   -0.72358E-01   -0.71970E-01  -273.596201856      -273.596204888      -273.596203336     0.264E-03
predicted gradient component=    0.1515585012E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.7235806571E-01   0.2637504387E-03   0.7305838991E-02 after     31 steps, step: 0.0063154358
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.72268E-01   -0.72360E-01   -0.72176E-01  -273.596201908      -273.596204836      -273.596203336     0.772E-03
predicted gradient component=    0.1463995005E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.7236036626E-01   0.7718352217E-03   0.3179299308E-02 after     32 steps, step: 0.0091253504
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.72285E-01   -0.72364E-01   -0.72206E-01  -273.596201877      -273.596204867      -273.596203336     0.230E-03
predicted gradient component=    0.1494962504E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.7236429184E-01   0.2302600852E-03   0.5424741953E-02 after     33 steps, step: 0.0032615634
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.72152E-01   -0.72365E-01   -0.71939E-01  -273.596201879      -273.596204865      -273.596203336     0.198E-03
predicted gradient component=    0.1492905000E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.7236545992E-01   0.1976726542E-03   0.1614139192E-02 after     34 steps, step: 0.0015176709
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.72142E-01   -0.72368E-01   -0.71916E-01  -273.596201887      -273.596204857      -273.596203336     0.180E-03
predicted gradient component=    0.1485398997E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.7236792240E-01   0.1797883875E-03   0.3402722766E-02 after     35 steps, step: 0.0045550830
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.72234E-01   -0.72370E-01   -0.72098E-01  -273.596201876      -273.596204868      -273.596203336     0.221E-03
predicted gradient component=    0.1496359999E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.7236996941E-01   0.2212673348E-03   0.2828540755E-02 after     36 steps, step: 0.0062809469
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.72213E-01   -0.72368E-01   -0.72058E-01  -273.596201869      -273.596204875      -273.596203336     0.588E-03
predicted gradient component=    0.1503322522E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.7236836871E-01   0.5883904306E-03   0.2211884920E-02 after     37 steps, step: 0.0057585934
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.72268E-01   -0.72371E-01   -0.72165E-01  -273.596201876      -273.596204868      -273.596203336     0.618E-04
predicted gradient component=    0.1496321005E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.7237082915E-01   0.6178032256E-04   0.3399775639E-02 after     38 steps, step: 0.0030024550
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.72240E-01   -0.72371E-01   -0.72109E-01  -273.596201876      -273.596204868      -273.596203336     0.466E-04
predicted gradient component=    0.1496202003E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.7237094076E-01   0.4656660036E-04   0.1542126309E-03 after     39 steps, step: 0.0003141096
 xmylbfgs> Smallest eigenvalue converged in   39 steps. Eigenvalue=     -0.0723709 RMS force=      0.0000466 % change=    0.15421E-03
 xmylbfgs> Diagonal inverse Hessian elements are now         0.3149568363
beig> Overlap with previous vector=      0.6779537
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1    0.149631E-02   -0.723709E-01  0.200000E-01  0.220000E-01    0.172247E-01
 -------------------------------------------------------------------------------
 mylbfgs> Resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.5961884        0.3887087944E-01 after      0 steps
 mylbfgs> true and projected RMS:     0.3887087960E-01    0.3887087944E-01
 mylbfgs> Energy and RMS force=    -273.5978622        0.3456031272E-01 after      1 steps, step:  0.67993E-02
 mylbfgs> true and projected RMS:     0.3456031304E-01    0.3456031272E-01
 mylbfgs> Energy and RMS force=    -273.6016765        0.2345937412E-01 after      2 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.2345939607E-01    0.2345937412E-01
 mylbfgs> Energy and RMS force=    -273.6040908        0.1377166158E-01 after      3 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1377180928E-01    0.1377166158E-01
 mylbfgs> Energy and RMS force=    -273.6053514        0.5946138489E-02 after      4 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.5946901143E-02    0.5946138489E-02
 bfgsts> RMS grad=    0.5946901143E-02 subspace grad=    0.5946138489E-02 unscaled EF step length=    0.2066676506E-01

 BFGSTS> Beginning of optimization cycle    2.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.56837E-01   -0.57334E-01   -0.56340E-01  -273.605350787      -273.605352065      -273.605351397     0.175E-01
predicted gradient component=    0.6388435168E-03
xmylbfgs> Eigenvalue and RMS=   -0.5733441867E-01    0.1750618931E-01 after      0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.57020E-01   -0.57477E-01   -0.56563E-01  -273.605350780      -273.605352072      -273.605351397     0.172E-01
predicted gradient component=    0.6462940121E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.5747673364E-01   0.1719430803E-01   0.2476044904     after      1 steps, step: 0.0013791000
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.63827E-01   -0.64320E-01   -0.63334E-01  -273.605350873      -273.605351986      -273.605351397     0.117E-01
predicted gradient component=    0.5565425170E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.6432023885E-01   0.1173971081E-01    10.63973849     after      2 steps, step: 0.1000000000
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.65536E-01   -0.66081E-01   -0.64991E-01  -273.605351336      -273.605351525      -273.605351397     0.275E-01
predicted gradient component=    0.9455999361E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.6608148978E-01   0.2748629671E-01    2.665271214     after      3 steps, step: 0.0979840951
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.68153E-01   -0.68658E-01   -0.67648E-01  -273.605351474      -273.605351389      -273.605351397     0.138E-01
predicted gradient component=   -0.4216647653E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.6865845502E-01   0.1378747093E-01    3.753310853     after      4 steps, step: 0.0316994251
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.70541E-01   -0.70953E-01   -0.70129E-01  -273.605351879      -273.605350987      -273.605351397     0.905E-02
predicted gradient component=   -0.4458464957E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.7095339941E-01   0.9050614909E-02    3.234438952     after      5 steps, step: 0.0609171967
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.71878E-01   -0.72410E-01   -0.71346E-01  -273.605352202      -273.605350665      -273.605351397     0.855E-02
predicted gradient component=   -0.7686130061E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.7241025742E-01   0.8549674485E-02    2.011949776     after      6 steps, step: 0.0685968737
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.72859E-01   -0.73291E-01   -0.72427E-01  -273.605352195      -273.605350673      -273.605351397     0.822E-02
predicted gradient component=   -0.7606325028E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.7329125257E-01   0.8219612523E-02    1.202046796     after      7 steps, step: 0.0710312398
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.72666E-01   -0.73139E-01   -0.72193E-01  -273.605351985      -273.605350883      -273.605351397     0.127E-01
predicted gradient component=   -0.5510489984E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.7313934588E-01   0.1270244745E-01   0.2076948988     after      8 steps, step: 0.0330151117
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.73187E-01   -0.73624E-01   -0.72750E-01  -273.605352149      -273.605350719      -273.605351397     0.289E-02
predicted gradient component=   -0.7154055197E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.7362381735E-01   0.2889668773E-02   0.6580363394     after      9 steps, step: 0.0212196217
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.73292E-01   -0.73687E-01   -0.72897E-01  -273.605352171      -273.605350697      -273.605351397     0.235E-02
predicted gradient component=   -0.7373319875E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.7368660001E-01   0.2353933879E-02   0.8520227358E-01 after     10 steps, step: 0.0040258170
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.73469E-01   -0.73937E-01   -0.73001E-01  -273.605352260      -273.605350608      -273.605351397     0.320E-02
predicted gradient component=   -0.8260375068E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.7393684079E-01   0.3197430582E-02   0.3384520765     after     11 steps, step: 0.0280127450
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.73734E-01   -0.74056E-01   -0.73412E-01  -273.605352260      -273.605350608      -273.605351397     0.257E-02
predicted gradient component=   -0.8258599848E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.7405588742E-01   0.2568421446E-02   0.1607524215     after     12 steps, step: 0.0219287543
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.73492E-01   -0.73977E-01   -0.73007E-01  -273.605352197      -273.605350671      -273.605351397     0.717E-02
predicted gradient component=   -0.7628649996E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.7397724958E-01   0.7172519298E-02   0.1063000243     after     13 steps, step: 0.0310453189
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.73653E-01   -0.74137E-01   -0.73169E-01  -273.605352182      -273.605350687      -273.605351397     0.829E-03
predicted gradient component=   -0.7475665029E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.7413710857E-01   0.8292630125E-03   0.2156261435     after     14 steps, step: 0.0082883455
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.73656E-01   -0.74143E-01   -0.73169E-01  -273.605352173      -273.605350696      -273.605351397     0.645E-03
predicted gradient component=   -0.7382809883E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.7414342797E-01   0.6454352272E-03   0.8523201233E-02 after     15 steps, step: 0.0023949990
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.73638E-01   -0.74155E-01   -0.73121E-01  -273.605352129      -273.605350740      -273.605351397     0.892E-03
predicted gradient component=   -0.6945840028E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.7415475315E-01   0.8921922891E-03   0.1527236649E-01 after     16 steps, step: 0.0064756743
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.73687E-01   -0.74155E-01   -0.73219E-01  -273.605352142      -273.605350726      -273.605351397     0.144E-02
predicted gradient component=   -0.7080145110E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.7415483848E-01   0.1437575244E-02   0.1150713702E-03 after     17 steps, step: 0.0054169253
 xmylbfgs> Smallest eigenvalue converged in   17 steps. Eigenvalue=     -0.0741548 RMS force=      0.0014376 % change=    0.11507E-03
 xmylbfgs> Diagonal inverse Hessian elements are now         0.6739044365
beig> Overlap with previous vector=      0.9192019
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1   -0.707987E-03   -0.741548E-01 -0.954654E-02  0.242000E-01    0.216776E-01
 -------------------------------------------------------------------------------
 mylbfgs> Not resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6053480        0.5947180280E-02 after      0 steps
 mylbfgs> true and projected RMS:     0.5947180723E-02    0.5947180280E-02
 mylbfgs> Energy and RMS force=    -273.6058004        0.2630114375E-02 after      1 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.2630114398E-02    0.2630114375E-02
 mylbfgs> Energy and RMS force=    -273.6059225        0.2730004003E-02 after      2 steps, step:  0.10308E-01
 mylbfgs> true and projected RMS:     0.2730007236E-02    0.2730004003E-02
 mylbfgs> Energy and RMS force=    -273.6061247        0.2543752929E-02 after      3 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.2543957049E-02    0.2543752929E-02
 mylbfgs> Energy and RMS force=    -273.6062622        0.2596242740E-02 after      4 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.2597463894E-02    0.2596242740E-02
 bfgsts> RMS grad=    0.2597463894E-02 subspace grad=    0.2596242740E-02 unscaled EF step length=    0.9546544384E-02

 BFGSTS> Beginning of optimization cycle    3.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.68086E-01   -0.68041E-01   -0.68131E-01  -273.606262735      -273.606261666      -273.606262166     0.651E-02
predicted gradient component=   -0.5342499776E-03
xmylbfgs> Eigenvalue and RMS=   -0.6804063695E-01    0.6510153344E-02 after      0 steps
 xmylbfgs> Turning off convergence after 0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.67943E-01   -0.68028E-01   -0.67858E-01  -273.606262736      -273.606261665      -273.606262166     0.649E-02
predicted gradient component=   -0.5353484767E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.6802789662E-01   0.6492453459E-02   0.1872809548E-01 after      1 steps, step: 0.0001907194
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.67499E-01   -0.67710E-01   -0.67288E-01  -273.606263330      -273.606261070      -273.606262166     0.197E-01
predicted gradient component=   -0.1129927483E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.6770999994E-01   0.1970566213E-01   0.4694973930     after      2 steps, step: 0.1000000000
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.69191E-01   -0.69272E-01   -0.69110E-01  -273.606263139      -273.606261263      -273.606262166     0.972E-02
predicted gradient component=   -0.9380624988E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.6927209756E-01   0.9724764833E-02    2.255017072     after      3 steps, step: 0.0326192400
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.69507E-01   -0.69608E-01   -0.69406E-01  -273.606263120      -273.606261282      -273.606262166     0.333E-02
predicted gradient component=   -0.9192764878E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.6960814285E-01   0.3330677929E-02   0.4827672086     after      4 steps, step: 0.0132404438
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.69708E-01   -0.69691E-01   -0.69725E-01  -273.606263149      -273.606261254      -273.606262166     0.255E-02
predicted gradient component=   -0.9475139962E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.6969125627E-01   0.2546179555E-02   0.1192594699     after      5 steps, step: 0.0052195853
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.69852E-01   -0.69931E-01   -0.69773E-01  -273.606263295      -273.606261107      -273.606262166     0.309E-02
predicted gradient component=   -0.1093899982E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.6993125050E-01   0.3088165056E-02   0.3431859461     after      6 steps, step: 0.0257917686
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.70052E-01   -0.70055E-01   -0.70049E-01  -273.606263407      -273.606260996      -273.606262166     0.332E-02
predicted gradient component=   -0.1205128001E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.7005489099E-01   0.3324387543E-02   0.1764908822     after      7 steps, step: 0.0202672993
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.70031E-01   -0.70096E-01   -0.69966E-01  -273.606263563      -273.606260840      -273.606262166     0.392E-02
predicted gradient component=   -0.1361442486E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.7009609406E-01   0.3915416199E-02   0.5878083674E-01 after      8 steps, step: 0.0310110225
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.70151E-01   -0.70161E-01   -0.70141E-01  -273.606263510      -273.606260892      -273.606262166     0.840E-03
predicted gradient component=   -0.1309033507E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.7016090050E-01   0.8398348904E-03   0.9236830908E-01 after      9 steps, step: 0.0095944350
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.70069E-01   -0.70168E-01   -0.69971E-01  -273.606263498      -273.606260905      -273.606262166     0.640E-03
predicted gradient component=   -0.1296484498E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.7016751042E-01   0.6400890826E-03   0.9420207246E-02 after     10 steps, step: 0.0024350749
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.70052E-01   -0.70177E-01   -0.69927E-01  -273.606263488      -273.606260915      -273.606262166     0.630E-03
predicted gradient component=   -0.1286144993E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.7017714210E-01   0.6295723660E-03   0.1372480418E-01 after     11 steps, step: 0.0039739486
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.70116E-01   -0.70180E-01   -0.70052E-01  -273.606263491      -273.606260912      -273.606262166     0.142E-02
predicted gradient component=   -0.1289736986E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.7017955965E-01   0.1416063696E-02   0.3444805048E-02 after     12 steps, step: 0.0060614605
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.70041E-01   -0.70190E-01   -0.69892E-01  -273.606263490      -273.606260913      -273.606262166     0.481E-03
predicted gradient component=   -0.1288267498E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.7018993399E-01   0.4808177936E-03   0.1478038443E-01 after     13 steps, step: 0.0014888866
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.70182E-01   -0.70192E-01   -0.70172E-01  -273.606263492      -273.606260911      -273.606262166     0.318E-03
predicted gradient component=   -0.1290296012E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.7019248505E-01   0.3182850255E-03   0.3634378452E-02 after     14 steps, step: 0.0015967746
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.70132E-01   -0.70194E-01   -0.70070E-01  -273.606263492      -273.606260911      -273.606262166     0.237E-03
predicted gradient component=   -0.1290446988E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.7019378512E-01   0.2366545207E-03   0.1852112971E-02 after     15 steps, step: 0.0021193710
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.69994E-01   -0.70195E-01   -0.69793E-01  -273.606263490      -273.606260912      -273.606262166     0.144E-03
predicted gradient component=   -0.1288904997E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.7019496739E-01   0.1438321684E-03   0.1684272239E-02 after     16 steps, step: 0.0017119798
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.70145E-01   -0.70195E-01   -0.70095E-01  -273.606263488      -273.606260915      -273.606262166     0.297E-03
predicted gradient component=   -0.1286393513E-02
xmylbfgs> Eigenvalue, RMS, % change=  -0.7019525514E-01   0.2971745572E-03   0.4099148456E-03 after     17 steps, step: 0.0017249030
 xmylbfgs> Smallest eigenvalue converged in   17 steps. Eigenvalue=     -0.0701953 RMS force=      0.0002972 % change=    0.40991E-03
 xmylbfgs> Diagonal inverse Hessian elements are now         0.8604573207
beig> Overlap with previous vector=      0.9918091
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1   -0.128644E-02   -0.701953E-01 -0.183204E-01  0.266200E-01    0.398539E-01
 -------------------------------------------------------------------------------
 mylbfgs> Not resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6062501        0.2588162105E-02 after      0 steps
 mylbfgs> true and projected RMS:     0.2588173573E-02    0.2588162105E-02
 mylbfgs> Energy and RMS force=    -273.6063661        0.1629249240E-02 after      1 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1629319891E-02    0.1629249240E-02
 mylbfgs> Energy and RMS force=    -273.6064388        0.1320663892E-02 after      2 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1321068608E-02    0.1320663892E-02
 mylbfgs> Energy and RMS force=    -273.6064986        0.1233977166E-02 after      3 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1235018479E-02    0.1233977166E-02
 mylbfgs> Energy and RMS force=    -273.6065568        0.1408012243E-02 after      4 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1409316898E-02    0.1408012243E-02
 bfgsts> RMS grad=    0.1409316898E-02 subspace grad=    0.1408012243E-02 unscaled EF step length=    0.1832044345E-01

 BFGSTS> Beginning of optimization cycle    4.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.63963E-01   -0.63711E-01   -0.64215E-01  -273.606557256      -273.606556443      -273.606556818     0.764E-02
predicted gradient component=   -0.4067345003E-03
xmylbfgs> Eigenvalue and RMS=   -0.6371143276E-01    0.7636586003E-02 after      0 steps
 xmylbfgs> Turning off convergence after 0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.63831E-01   -0.63711E-01   -0.63951E-01  -273.606557256      -273.606556443      -273.606556818     0.758E-02
predicted gradient component=   -0.4064105212E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.6371134819E-01   0.7577287357E-02   0.1327248243E-03 after      1 steps, step: 0.0002624285
 xmylbfgs> Smallest eigenvalue converged in    1 steps. Eigenvalue=     -0.0637113 RMS force=      0.0075773 % change=    0.13272E-03
 xmylbfgs> Diagonal inverse Hessian elements are now         0.1000000000
beig> Overlap with previous vector=      0.9999986
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1   -0.406455E-03   -0.637113E-01 -0.637937E-02  0.292820E-01    0.175717E-01
 -------------------------------------------------------------------------------
 mylbfgs> Not resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6065555        0.1410755667E-02 after      0 steps
 mylbfgs> true and projected RMS:     0.1410756070E-02    0.1410755667E-02
 mylbfgs> Energy and RMS force=    -273.6066146        0.1382193557E-02 after      1 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1382205266E-02    0.1382193557E-02
 mylbfgs> Energy and RMS force=    -273.6066597        0.1162108860E-02 after      2 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1162128773E-02    0.1162108860E-02
 mylbfgs> Energy and RMS force=    -273.6066932        0.5560364487E-03 after      3 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.5560604484E-03    0.5560364487E-03
 mylbfgs> Energy and RMS force=    -273.6067081        0.6157551662E-03 after      4 steps, step:  0.92996E-02
 mylbfgs> true and projected RMS:     0.6157842526E-03    0.6157551662E-03
 mylbfgs> Energy and RMS force=    -273.6067346        0.9116918763E-03 after      5 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.9118066935E-03    0.9116918763E-03
 mylbfgs> Energy and RMS force=    -273.6067557        0.1112401981E-02 after      6 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1112780826E-02    0.1112401981E-02
 mylbfgs> Energy and RMS force=    -273.6067709        0.7132582015E-03 after      7 steps, step:  0.11990E-01
 mylbfgs> true and projected RMS:     0.7146179025E-03    0.7132582015E-03
 mylbfgs> Energy and RMS force=    -273.6067790        0.3657330081E-03 after      8 steps, step:  0.48493E-02
 mylbfgs> true and projected RMS:     0.3691148711E-03    0.3657330081E-03
 mylbfgs> Energy and RMS force=    -273.6067829        0.4070077098E-03 after      9 steps, step:  0.33013E-02
 mylbfgs> true and projected RMS:     0.4101892657E-03    0.4070077098E-03
 mylbfgs> Energy and RMS force=    -273.6067932        0.6061782795E-03 after     10 steps, step:  0.11124E-01
 mylbfgs> true and projected RMS:     0.6086450387E-03    0.6061782795E-03
 bfgsts> RMS grad=    0.6086450387E-03 subspace grad=    0.6061782795E-03 unscaled EF step length=    0.6379368253E-02

 BFGSTS> Beginning of optimization cycle    5.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.61242E-01   -0.61024E-01   -0.61460E-01  -273.606793628      -273.606792894      -273.606793230     0.172E-01
predicted gradient component=   -0.3670720048E-03
xmylbfgs> Eigenvalue and RMS=   -0.6102435332E-01    0.1719075023E-01 after      0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.61285E-01   -0.61163E-01   -0.61407E-01  -273.606793629      -273.606792893      -273.606793230     0.168E-01
predicted gradient component=   -0.3681244891E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.6116314774E-01   0.1680410700E-01   0.2269249207     after      1 steps, step: 0.0013298485
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.65059E-01   -0.64969E-01   -0.65149E-01  -273.606793649      -273.606792877      -273.606793230     0.878E-02
predicted gradient component=   -0.3857414868E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.6496949388E-01   0.8779865405E-02    5.858666751     after      2 steps, step: 0.0726878482
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.64762E-01   -0.64674E-01   -0.64850E-01  -273.606793664      -273.606792862      -273.606793230     0.170E-01
predicted gradient component=   -0.4011789940E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.6467398387E-01   0.1703434648E-01   0.4569225453     after      3 steps, step: 0.0299157710
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.65474E-01   -0.65452E-01   -0.65496E-01  -273.606793649      -273.606792877      -273.606793230     0.417E-02
predicted gradient component=   -0.3858379785E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.6545201639E-01   0.4166006800E-02    1.188706734     after      4 steps, step: 0.0148129573
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.65693E-01   -0.65567E-01   -0.65819E-01  -273.606793643      -273.606792884      -273.606793230     0.294E-02
predicted gradient component=   -0.3794604879E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.6556662382E-01   0.2937535471E-02   0.1747953685     after      5 steps, step: 0.0053914245
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.65887E-01   -0.65800E-01   -0.65974E-01  -273.606793623      -273.606792904      -273.606793230     0.215E-02
predicted gradient component=   -0.3593924873E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.6580030607E-01   0.2145599366E-02   0.3551385465     after      6 steps, step: 0.0227501140
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.66011E-01   -0.65888E-01   -0.66134E-01  -273.606793620      -273.606792907      -273.606793230     0.173E-02
predicted gradient component=   -0.3561875133E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.6588848674E-01   0.1734503881E-02   0.1338331991     after      7 steps, step: 0.0116514439
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.66082E-01   -0.65933E-01   -0.66231E-01  -273.606793627      -273.606792899      -273.606793230     0.422E-02
predicted gradient component=   -0.3640859916E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.6593331667E-01   0.4220373028E-02   0.6799284528E-01 after      8 steps, step: 0.0347992522
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.66168E-01   -0.66002E-01   -0.66334E-01  -273.606793625      -273.606792902      -273.606793230     0.233E-02
predicted gradient component=   -0.3613159834E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.6600203707E-01   0.2331377528E-02   0.1041185914     after      9 steps, step: 0.0086236755
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.66157E-01   -0.66024E-01   -0.66290E-01  -273.606793626      -273.606792900      -273.606793230     0.502E-03
predicted gradient component=   -0.3629535001E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.6602392852E-01   0.5023094087E-03   0.3315685007E-01 after     10 steps, step: 0.0067419004
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.66167E-01   -0.66026E-01   -0.66308E-01  -273.606793628      -273.606792899      -273.606793230     0.393E-03
predicted gradient component=   -0.3641164881E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.6602572023E-01   0.3927435320E-03   0.2713661411E-02 after     11 steps, step: 0.0009854206
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.66172E-01   -0.66031E-01   -0.66313E-01  -273.606793630      -273.606792897      -273.606793230     0.398E-03
predicted gradient component=   -0.3665400072E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.6603074278E-01   0.3982542811E-03   0.7606377185E-02 after     12 steps, step: 0.0037254291
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.66194E-01   -0.66035E-01   -0.66353E-01  -273.606793631      -273.606792896      -273.606793230     0.516E-03
predicted gradient component=   -0.3677330085E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.6603475392E-01   0.5157714735E-03   0.6074284305E-02 after     13 steps, step: 0.0038553011
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.66154E-01   -0.66036E-01   -0.66272E-01  -273.606793631      -273.606792896      -273.606793230     0.410E-03
predicted gradient component=   -0.3677129996E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.6603566792E-01   0.4095298789E-03   0.1384100809E-02 after     14 steps, step: 0.0036124141
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.66104E-01   -0.66037E-01   -0.66171E-01  -273.606793631      -273.606792896      -273.606793230     0.126E-03
predicted gradient component=   -0.3674890081E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.6603670082E-01   0.1261555679E-03   0.1564134124E-02 after     15 steps, step: 0.0011730835
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.66138E-01   -0.66037E-01   -0.66239E-01  -273.606793631      -273.606792896      -273.606793230     0.999E-04
predicted gradient component=   -0.3675280027E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.6603684974E-01   0.9986987849E-04   0.2254977732E-03 after     16 steps, step: 0.0003745135
 xmylbfgs> Smallest eigenvalue converged in   16 steps. Eigenvalue=     -0.0660368 RMS force=      0.0000999 % change=    0.22550E-03
 xmylbfgs> Diagonal inverse Hessian elements are now         0.2303610509
beig> Overlap with previous vector=      0.9921319
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1   -0.367692E-03   -0.660368E-01 -0.556781E-02  0.300000E-01    0.123938E-01
 -------------------------------------------------------------------------------
 mylbfgs> Not resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6067922        0.6061883910E-03 after      0 steps
 mylbfgs> true and projected RMS:     0.6061887735E-03    0.6061883910E-03
 mylbfgs> Energy and RMS force=    -273.6068088        0.8547044958E-03 after      1 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.8547051587E-03    0.8547044958E-03
 mylbfgs> Energy and RMS force=    -273.6068249        0.8036619983E-03 after      2 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.8036634138E-03    0.8036619983E-03
 mylbfgs> Energy and RMS force=    -273.6068415        0.6903612019E-03 after      3 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.6903648102E-03    0.6903612019E-03
 mylbfgs> Energy and RMS force=    -273.6068580        0.6234289748E-03 after      4 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.6234392810E-03    0.6234289748E-03
 bfgsts> RMS grad=    0.6234392810E-03 subspace grad=    0.6234289748E-03 unscaled EF step length=    0.5567808582E-02

 BFGSTS> Beginning of optimization cycle    6.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.65297E-01   -0.65307E-01   -0.65287E-01  -273.606858039      -273.606857991      -273.606857982     0.337E-02
predicted gradient component=   -0.2399249865E-04
xmylbfgs> Eigenvalue and RMS=   -0.6530656060E-01    0.3371173912E-02 after      0 steps
 xmylbfgs> Turning off convergence after 0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.65154E-01   -0.65297E-01   -0.65011E-01  -273.606858039      -273.606857991      -273.606857982     0.335E-02
predicted gradient component=   -0.2391200837E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.6529695382E-01   0.3354851575E-02   0.1471245668E-01 after      1 steps, step: 0.0000511417
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.65225E-01   -0.65331E-01   -0.65119E-01  -273.606858050      -273.606857980      -273.606857982     0.502E-02
predicted gradient component=   -0.3488750622E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.6533111093E-01   0.5019957837E-02   0.5228307808E-01 after      2 steps, step: 0.0171318541
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.65293E-01   -0.65426E-01   -0.65160E-01  -273.606858049      -273.606857981      -273.606857982     0.158E-02
predicted gradient component=   -0.3424150918E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.6542567532E-01   0.1577260291E-02   0.1445371150     after      3 steps, step: 0.0065048467
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.65348E-01   -0.65436E-01   -0.65260E-01  -273.606858049      -273.606857982      -273.606857982     0.740E-03
predicted gradient component=   -0.3357101264E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.6543552769E-01   0.7400844311E-03   0.1505660826E-01 after      4 steps, step: 0.0015669707
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.65214E-01   -0.65442E-01   -0.64986E-01  -273.606858049      -273.606857981      -273.606857982     0.559E-03
predicted gradient component=   -0.3364198164E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.6544186347E-01   0.5591979920E-03   0.9681534161E-02 after      5 steps, step: 0.0016656107
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.65241E-01   -0.65450E-01   -0.65032E-01  -273.606858050      -273.606857981      -273.606857982     0.623E-03
predicted gradient component=   -0.3458652031E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.6544994669E-01   0.6228594959E-03   0.1235023503E-01 after      6 steps, step: 0.0036118553
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.65327E-01   -0.65454E-01   -0.65200E-01  -273.606858050      -273.606857980      -273.606857982     0.107E-02
predicted gradient component=   -0.3493249778E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.6545394431E-01   0.1070494813E-02   0.6107531691E-02 after      7 steps, step: 0.0045531708
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.65374E-01   -0.65459E-01   -0.65289E-01  -273.606858051      -273.606857980      -273.606857982     0.377E-03
predicted gradient component=   -0.3541700266E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.6545863053E-01   0.3767819973E-03   0.7159053856E-02 after      8 steps, step: 0.0021150156
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.65300E-01   -0.65460E-01   -0.65139E-01  -273.606858050      -273.606857980      -273.606857982     0.282E-03
predicted gradient component=   -0.3514099944E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.6546040824E-01   0.2819539494E-03   0.2715702920E-02 after      9 steps, step: 0.0012329378
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.65380E-01   -0.65462E-01   -0.65298E-01  -273.606858050      -273.606857981      -273.606857982     0.291E-03
predicted gradient component=   -0.3462298537E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.6546209905E-01   0.2905412592E-03   0.2582882845E-02 after     10 steps, step: 0.0018769197
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.65271E-01   -0.65463E-01   -0.65079E-01  -273.606858049      -273.606857981      -273.606857982     0.173E-03
predicted gradient component=   -0.3432151630E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.6546346295E-01   0.1730324114E-03   0.2083465187E-02 after     11 steps, step: 0.0023068302
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.65442E-01   -0.65463E-01   -0.65421E-01  -273.606858050      -273.606857981      -273.606857982     0.481E-03
predicted gradient component=   -0.3453297381E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.6546271793E-01   0.4811633554E-03   0.1138093861E-02 after     12 steps, step: 0.0011685861
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.65307E-01   -0.65464E-01   -0.65150E-01  -273.606858049      -273.606857981      -273.606857982     0.515E-04
predicted gradient component=   -0.3435252438E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.6546361050E-01   0.5149138818E-04   0.1363460768E-02 after     13 steps, step: 0.0006109373
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.65478E-01   -0.65463E-01   -0.65493E-01  -273.606858050      -273.606857981      -273.606857982     0.408E-04
predicted gradient component=   -0.3439799912E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.6546327334E-01   0.4079300814E-04   0.5150322516E-03 after     14 steps, step: 0.0000766697
 xmylbfgs> Smallest eigenvalue converged in   14 steps. Eigenvalue=     -0.0654633 RMS force=      0.0000408 % change=    0.51503E-03
 xmylbfgs> Diagonal inverse Hessian elements are now         0.1492733934
beig> Overlap with previous vector=      0.9997298
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1   -0.345018E-04   -0.654633E-01 -0.527041E-03  0.300000E-01    0.102087E-02
 -------------------------------------------------------------------------------
 mylbfgs> Not resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6068580        0.6234179729E-03 after      0 steps
 mylbfgs> true and projected RMS:     0.6234179729E-03    0.6234179729E-03
 mylbfgs> Energy and RMS force=    -273.6068731        0.4038685214E-03 after      1 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.4038687112E-03    0.4038685214E-03
 mylbfgs> Energy and RMS force=    -273.6068840        0.2899423617E-03 after      2 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.2899457055E-03    0.2899423617E-03
 mylbfgs> Energy and RMS force=    -273.6068841        0.6629482070E-03 after      3 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.6629538431E-03    0.6629482070E-03
 mylbfgs> Energy and RMS force=    -273.6068896        0.1413225270E-03 after      4 steps, step:  0.53539E-02
 mylbfgs> true and projected RMS:     0.1413522700E-03    0.1413225270E-03
 bfgsts> RMS grad=    0.1413522700E-03 subspace grad=    0.1413225270E-03 unscaled EF step length=    0.5270410618E-03

 BFGSTS> Beginning of optimization cycle    7.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.64925E-01   -0.64632E-01   -0.65218E-01  -273.606889640      -273.606889601      -273.606889588     0.178E-02
predicted gradient component=   -0.1925650395E-04
xmylbfgs> Eigenvalue and RMS=   -0.6463225576E-01    0.1778531925E-02 after      0 steps
 xmylbfgs> Turning off convergence after 0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.64800E-01   -0.64621E-01   -0.64978E-01  -273.606889640      -273.606889601      -273.606889588     0.177E-02
predicted gradient component=   -0.1921497983E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.6462136822E-01   0.1774338087E-02   0.1684820318E-01 after      1 steps, step: 0.0000142343
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.64693E-01   -0.64629E-01   -0.64757E-01  -273.606889639      -273.606889602      -273.606889588     0.280E-02
predicted gradient component=   -0.1815149631E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.6462881455E-01   0.2804035626E-02   0.1152168999E-01 after      2 steps, step: 0.0115587836
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.64857E-01   -0.64666E-01   -0.65048E-01  -273.606889639      -273.606889602      -273.606889588     0.121E-02
predicted gradient component=   -0.1829150165E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.6466574363E-01   0.1208815682E-02   0.5710763929E-01 after      3 steps, step: 0.0045238898
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.64693E-01   -0.64673E-01   -0.64713E-01  -273.606889639      -273.606889602      -273.606889588     0.502E-03
predicted gradient component=   -0.1860149723E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.6467259761E-01   0.5024670792E-03   0.1059796750E-01 after      4 steps, step: 0.0014604407
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.64716E-01   -0.64676E-01   -0.64756E-01  -273.606889639      -273.606889602      -273.606889588     0.404E-03
predicted gradient component=   -0.1870199640E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.6467569979E-01   0.4036110887E-03   0.4796510882E-02 after      5 steps, step: 0.0013252669
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.64788E-01   -0.64682E-01   -0.64894E-01  -273.606889639      -273.606889602      -273.606889588     0.482E-03
predicted gradient component=   -0.1881301159E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.6468169767E-01   0.4815413868E-03   0.9272924989E-02 after      6 steps, step: 0.0044105058
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.64692E-01   -0.64681E-01   -0.64703E-01  -273.606889639      -273.606889602      -273.606889588     0.114E-02
predicted gradient component=   -0.1882202127E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.6468060812E-01   0.1136228802E-02   0.1684507882E-02 after      7 steps, step: 0.0037198103
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.64837E-01   -0.64685E-01   -0.64989E-01  -273.606889639      -273.606889602      -273.606889588     0.333E-03
predicted gradient component=   -0.1876952638E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.6468462134E-01   0.3327249529E-03   0.6204279522E-02 after      8 steps, step: 0.0012538326
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.64845E-01   -0.64686E-01   -0.65004E-01  -273.606889639      -273.606889602      -273.606889588     0.197E-03
predicted gradient component=   -0.1867547894E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.6468567585E-01   0.1973760165E-03   0.1630214771E-02 after      9 steps, step: 0.0007042301
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.64822E-01   -0.64688E-01   -0.64956E-01  -273.606889639      -273.606889602      -273.606889588     0.178E-03
predicted gradient component=   -0.1857699772E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.6468780466E-01   0.1779106164E-03   0.3290889619E-02 after     10 steps, step: 0.0025301084
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.64832E-01   -0.64688E-01   -0.64976E-01  -273.606889639      -273.606889602      -273.606889588     0.980E-04
predicted gradient component=   -0.1842897746E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.6468775819E-01   0.9798461208E-04   0.7183863048E-04 after     11 steps, step: 0.0013579293
 xmylbfgs> Smallest eigenvalue converged in   11 steps. Eigenvalue=     -0.0646878 RMS force=      0.0000980 % change=    0.71839E-04
 xmylbfgs> Diagonal inverse Hessian elements are now         0.7995433147
beig> Overlap with previous vector=      0.9998546
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1   -0.186520E-04   -0.646878E-01 -0.288339E-03  0.300000E-01    0.402162E-02
 -------------------------------------------------------------------------------
 mylbfgs> Not resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6068896        0.1413313136E-03 after      0 steps
 mylbfgs> true and projected RMS:     0.1413313140E-03    0.1413313136E-03
 mylbfgs> Energy and RMS force=    -273.6068901        0.1065879395E-03 after      1 steps, step:  0.24070E-02
 mylbfgs> true and projected RMS:     0.1065879491E-03    0.1065879395E-03
 mylbfgs> Energy and RMS force=    -273.6068914        0.9870822404E-04 after      2 steps, step:  0.37112E-02
 mylbfgs> true and projected RMS:     0.9870823318E-04    0.9870822404E-04
 mylbfgs> Energy and RMS force=    -273.6068919        0.1501844607E-03 after      3 steps, step:  0.30939E-02
 mylbfgs> true and projected RMS:     0.1501844609E-03    0.1501844607E-03
 mylbfgs> Energy and RMS force=    -273.6068924        0.5862833168E-04 after      4 steps, step:  0.33521E-02
 mylbfgs> true and projected RMS:     0.5862834615E-04    0.5862833168E-04
 bfgsts> RMS grad=    0.5862834615E-04 subspace grad=    0.5862833168E-04 unscaled EF step length=    0.2883388500E-03

 BFGSTS> Beginning of optimization cycle    8.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.64258E-01   -0.64321E-01   -0.64196E-01  -273.606892462      -273.606892461      -273.606892429     0.207E-03
predicted gradient component=   -0.2200124527E-06
xmylbfgs> Eigenvalue and RMS=   -0.6432056419E-01    0.2073743609E-03 after      0 steps
 xmylbfgs> Turning off convergence after 0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.64234E-01   -0.64310E-01   -0.64158E-01  -273.606892462      -273.606892461      -273.606892429     0.205E-03
predicted gradient component=   -0.2090132512E-06
xmylbfgs> Eigenvalue, RMS, % change=  -0.6430961470E-01   0.2053092558E-03   0.1702621720E-01 after      1 steps, step: 0.0000001935
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.64093E-01   -0.64310E-01   -0.63876E-01  -273.606892461      -273.606892461      -273.606892429     0.192E-03
predicted gradient component=   -0.1414832695E-06
xmylbfgs> Eigenvalue, RMS, % change=  -0.6431007740E-01   0.1920140122E-03   0.7194975866E-03 after      2 steps, step: 0.0000283557
 xmylbfgs> Smallest eigenvalue converged in    2 steps. Eigenvalue=     -0.0643101 RMS force=      0.0001920 % change=    0.71950E-03
 xmylbfgs> Diagonal inverse Hessian elements are now         0.0002654930
beig> Overlap with previous vector=      0.9999999
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1   -0.274811E-06   -0.643101E-01 -0.427322E-05  0.300000E-01    0.515601E-01
 -------------------------------------------------------------------------------
 mylbfgs> Not resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6068924        0.5862622711E-04 after      0 steps
 mylbfgs> true and projected RMS:     0.5862622715E-04    0.5862622711E-04
 mylbfgs> Energy and RMS force=    -273.6068926        0.3633590851E-04 after      1 steps, step:  0.17524E-02
 mylbfgs> true and projected RMS:     0.3633590989E-04    0.3633590851E-04
 mylbfgs> Energy and RMS force=    -273.6068927        0.3148674802E-04 after      2 steps, step:  0.11625E-02
 mylbfgs> true and projected RMS:     0.3148675238E-04    0.3148674802E-04
 mylbfgs> Energy and RMS force=    -273.6068929        0.3786318351E-04 after      3 steps, step:  0.16448E-02
 mylbfgs> true and projected RMS:     0.3786319216E-04    0.3786318351E-04
 mylbfgs> Energy and RMS force=    -273.6068932        0.8186353288E-04 after      4 steps, step:  0.42826E-02
 mylbfgs> true and projected RMS:     0.8186354696E-04    0.8186353288E-04
 mylbfgs> Energy and RMS force=    -273.6068934        0.5019570021E-04 after      5 steps, step:  0.33544E-02
 mylbfgs> true and projected RMS:     0.5019584031E-04    0.5019570021E-04
 mylbfgs> Energy and RMS force=    -273.6068936        0.3689458683E-04 after      6 steps, step:  0.12548E-02
 mylbfgs> true and projected RMS:     0.3689481233E-04    0.3689458683E-04
 mylbfgs> Energy and RMS force=    -273.6068938        0.4155937973E-04 after      7 steps, step:  0.31154E-02
 mylbfgs> true and projected RMS:     0.4155958067E-04    0.4155937973E-04
 mylbfgs> Energy and RMS force=    -273.6068940        0.5809234238E-04 after      8 steps, step:  0.35915E-02
 mylbfgs> true and projected RMS:     0.5809248803E-04    0.5809234238E-04
 mylbfgs> Energy and RMS force=    -273.6068942        0.4633704737E-04 after      9 steps, step:  0.30337E-02
 mylbfgs> true and projected RMS:     0.4633714257E-04    0.4633704737E-04
 mylbfgs> Energy and RMS force=    -273.6068946        0.4091810937E-04 after     10 steps, step:  0.65235E-02
 mylbfgs> true and projected RMS:     0.4091815061E-04    0.4091810937E-04
 bfgsts> RMS grad=    0.4091815061E-04 subspace grad=    0.4091810937E-04 unscaled EF step length=    0.4273224465E-05

 BFGSTS> Beginning of optimization cycle    9.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.64369E-01   -0.63994E-01   -0.64744E-01  -273.606894606      -273.606894607      -273.606894575     0.484E-03
predicted gradient component=    0.4434923540E-06
xmylbfgs> Eigenvalue and RMS=   -0.6399358659E-01    0.4841057885E-03 after      0 steps
 xmylbfgs> Turning off convergence after 0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.64190E-01   -0.63982E-01   -0.64398E-01  -273.606894606      -273.606894607      -273.606894575     0.482E-03
predicted gradient component=    0.5369997780E-06
xmylbfgs> Eigenvalue, RMS, % change=  -0.6398237307E-01   0.4823113329E-03   0.1752594200E-01 after      1 steps, step: 0.0000010546
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.64190E-01   -0.63984E-01   -0.64396E-01  -273.606894606      -273.606894607      -273.606894575     0.274E-03
predicted gradient component=    0.5410072390E-06
xmylbfgs> Eigenvalue, RMS, % change=  -0.6398409230E-01   0.2740043454E-03   0.2686965032E-02 after      2 steps, step: 0.0004846621
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.64128E-01   -0.63985E-01   -0.64271E-01  -273.606894606      -273.606894607      -273.606894575     0.213E-03
predicted gradient component=    0.6529887742E-06
xmylbfgs> Eigenvalue, RMS, % change=  -0.6398499730E-01   0.2127738691E-03   0.1414383274E-02 after      3 steps, step: 0.0007780246
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.64278E-01   -0.63985E-01   -0.64571E-01  -273.606894606      -273.606894607      -273.606894575     0.205E-03
predicted gradient component=    0.6870095604E-06
xmylbfgs> Eigenvalue, RMS, % change=  -0.6398537293E-01   0.2051933368E-03   0.5870574659E-03 after      4 steps, step: 0.0008508103
 xmylbfgs> Smallest eigenvalue converged in    4 steps. Eigenvalue=     -0.0639854 RMS force=      0.0002052 % change=    0.58706E-03
 xmylbfgs> Diagonal inverse Hessian elements are now         0.3278815972
beig> Overlap with previous vector=      0.9999979
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1    0.581243E-06   -0.639854E-01  0.908399E-05  0.300000E-01    0.407825E-01
 -------------------------------------------------------------------------------
 mylbfgs> Not resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6068946        0.4091310479E-04 after      0 steps
 mylbfgs> true and projected RMS:     0.4091310494E-04    0.4091310479E-04
 mylbfgs> Energy and RMS force=    -273.6068950        0.6273463928E-04 after      1 steps, step:  0.80604E-02
 mylbfgs> true and projected RMS:     0.6273500853E-04    0.6273463928E-04
 mylbfgs> Energy and RMS force=    -273.6068954        0.4780242714E-04 after      2 steps, step:  0.97544E-02
 mylbfgs> true and projected RMS:     0.4780556094E-04    0.4780242714E-04
 mylbfgs> Energy and RMS force=    -273.6068956        0.2942525221E-04 after      3 steps, step:  0.34493E-02
 mylbfgs> true and projected RMS:     0.2943320985E-04    0.2942525221E-04
 mylbfgs> Energy and RMS force=    -273.6068957        0.2045559128E-04 after      4 steps, step:  0.12971E-02
 mylbfgs> true and projected RMS:     0.2046821468E-04    0.2045559128E-04
 mylbfgs> Energy and RMS force=    -273.6068958        0.2102548309E-04 after      5 steps, step:  0.10683E-02
 mylbfgs> true and projected RMS:     0.2103875370E-04    0.2102548309E-04
 mylbfgs> Energy and RMS force=    -273.6068959        0.1834232580E-04 after      6 steps, step:  0.24120E-02
 mylbfgs> true and projected RMS:     0.1835996773E-04    0.1834232580E-04
 mylbfgs> Energy and RMS force=    -273.6068959        0.2187062962E-04 after      7 steps, step:  0.23491E-02
 mylbfgs> true and projected RMS:     0.2188728672E-04    0.2187062962E-04
 mylbfgs> Energy and RMS force=    -273.6068960        0.1071500811E-04 after      8 steps, step:  0.11630E-02
 mylbfgs> true and projected RMS:     0.1075109992E-04    0.1071500811E-04
 mylbfgs> Energy and RMS force=    -273.6068960        0.6429466596E-05 after      9 steps, step:  0.25932E-03
 mylbfgs> true and projected RMS:     0.6489487771E-05    0.6429466596E-05
 mylbfgs> Diagonal inverse Hessian elements are now         1.5304114092
 mylbfgs> Final energy is   -273.60689597168300    
 bfgsts> RMS grad=    0.6489487771E-05 subspace grad=    0.6429466596E-05 unscaled EF step length=    0.9083991474E-05
 Converged to TS (number of iterations):          9
 DNEB run yielded 1 true transition state(s) time=      0.84
 Energies:
  -273.60689597168300     

 >>>>>  Path run for ts 2 ...
 bfgsts> resetting maximum uphill step size to     0.2000000000E-01

 bfgsts> Stepping away from saddle along softest mode + direction
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1    0.000000E+00   -0.639854E-01  0.100000E+00  0.181818E-01    0.100000E+01
 -------------------------------------------------------------------------------
 golden> golden a, b, c, d=     0.000000000        0.1000000000        0.3819660113E-01    0.6180339887E-01 initially
 golden> energy at ts, C and D and diff=    -273.606895971683        -273.606944748351        -273.607024737899       -0.128766215993892E-03
 golden> energy at ts, C and D and diff=    -273.606895971683        -273.607024738255        -273.607092162388       -0.196190705025856E-03
 golden> energy at ts, C and D and diff=    -273.606895971683        -273.607092162572        -273.607140108219       -0.244136536025508E-03
 golden> energy at ts, C and D and diff=    -273.606895971683        -273.607140108266        -273.607171952589       -0.275980905996676E-03
 golden> energy at ts, C and D and diff=    -273.606895971683        -273.607171952715        -273.607192429120       -0.296457437002573E-03
 golden> energy at ts, C and D and diff=    -273.606895971683        -273.607192429267        -273.607205376036       -0.309404353004084E-03
 golden> energy at ts, C and D and diff=    -273.606895971683        -273.607205376013        -273.607213485853       -0.317514169978494E-03
 golden> energy at ts, C and D and diff=    -273.606895971683        -273.607213485993        -273.607218538832       -0.322567148998587E-03
 golden> energy at ts, C and D and diff=    -273.606895971683        -273.607218538732        -273.607221677026       -0.325705343016125E-03
 golden> energy at ts, C and D and diff=    -273.606895971683        -273.607221677002        -273.607223622387       -0.327650703979998E-03
 path> golden section + pushoff, energy, delta, step:     -273.607223622387       -0.327650703979998E-03    0.995934690628392E-01
 mylbfgs> Resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6072242        0.9937481964E-03 after      0 steps
 mylbfgs> Energy and RMS force=    -273.6072243        0.9936047948E-03 after      1 steps, step:  0.44439E-05
 mylbfgs> Energy and RMS force=    -273.6073553        0.1202405726E-02 after      2 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6074848        0.1768043620E-02 after      3 steps, step:  0.20000E-01
 mylbfgs> Resetting LBFGS routine - step scaling factor was     0.3071817161E-02
 mylbfgs> Energy and RMS force=    -273.6074850        0.1765713583E-02 after      4 steps, step:  0.14067E-04
 mylbfgs> Energy and RMS force=    -273.6076014        0.1593527990E-02 after      5 steps, step:  0.16191E-01
 mylbfgs> Energy and RMS force=    -273.6076863        0.2398482454E-02 after      6 steps, step:  0.15494E-01
 mylbfgs> Energy and RMS force=    -273.6078024        0.3070491124E-02 after      7 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6079229        0.3497356282E-02 after      8 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6080446        0.3707235749E-02 after      9 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6081549        0.3987149976E-02 after     10 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6082660        0.3830234153E-02 after     11 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6083743        0.3470855265E-02 after     12 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6084541        0.3283104402E-02 after     13 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6085425        0.2221684005E-02 after     14 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6086031        0.8070628409E-03 after     15 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6086152        0.7079177932E-03 after     16 steps, step:  0.57872E-02
 mylbfgs> Energy and RMS force=    -273.6086216        0.5707358496E-03 after     17 steps, step:  0.36207E-02
 mylbfgs> Energy and RMS force=    -273.6086280        0.6594404109E-03 after     18 steps, step:  0.50153E-02
 mylbfgs> Energy and RMS force=    -273.6086416        0.8090185984E-03 after     19 steps, step:  0.10270E-01
 mylbfgs> Energy and RMS force=    -273.6086645        0.8911610328E-03 after     20 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6086705        0.1528054620E-02 after     21 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6086928        0.5229944826E-03 after     22 steps, step:  0.17909E-01
 mylbfgs> Energy and RMS force=    -273.6086987        0.2566239074E-03 after     23 steps, step:  0.90745E-02
 mylbfgs> Energy and RMS force=    -273.6087010        0.2111090541E-03 after     24 steps, step:  0.46011E-02
 mylbfgs> Energy and RMS force=    -273.6087031        0.2895766539E-03 after     25 steps, step:  0.38811E-02
 mylbfgs> Energy and RMS force=    -273.6087066        0.3665624970E-03 after     26 steps, step:  0.70075E-02
 mylbfgs> Energy and RMS force=    -273.6087095        0.4441325411E-03 after     27 steps, step:  0.87161E-02
 mylbfgs> Energy and RMS force=    -273.6087111        0.2770302461E-03 after     28 steps, step:  0.52733E-02
 mylbfgs> Energy and RMS force=    -273.6087118        0.7653319827E-04 after     29 steps, step:  0.17471E-02
 mylbfgs> Energy and RMS force=    -273.6087119        0.6854333214E-04 after     30 steps, step:  0.54821E-03
 mylbfgs> Energy and RMS force=    -273.6087121        0.7655208913E-04 after     31 steps, step:  0.75083E-03
 mylbfgs> Energy and RMS force=    -273.6087124        0.6249885913E-04 after     32 steps, step:  0.14321E-02
 mylbfgs> Energy and RMS force=    -273.6087126        0.5664205285E-04 after     33 steps, step:  0.19022E-02
 mylbfgs> Energy and RMS force=    -273.6087127        0.1746928796E-03 after     34 steps, step:  0.41985E-02
 mylbfgs> Energy and RMS force=    -273.6087130        0.5173836373E-04 after     35 steps, step:  0.63902E-03
 mylbfgs> Energy and RMS force=    -273.6087131        0.4439874438E-04 after     36 steps, step:  0.52746E-03
 mylbfgs> Energy and RMS force=    -273.6087133        0.4580701647E-04 after     37 steps, step:  0.17612E-02
 mylbfgs> Energy and RMS force=    -273.6087136        0.4762241709E-04 after     38 steps, step:  0.28605E-02
 mylbfgs> Energy and RMS force=    -273.6087135        0.1920446370E-03 after     39 steps, step:  0.59425E-02
 mylbfgs> Energy and RMS force=    -273.6087139        0.3645927024E-04 after     40 steps, step:  0.81608E-03
 mylbfgs> Energy and RMS force=    -273.6087140        0.1969420558E-04 after     41 steps, step:  0.43279E-03
 mylbfgs> Energy and RMS force=    -273.6087140        0.2346175779E-04 after     42 steps, step:  0.10136E-02
 mylbfgs> Energy and RMS force=    -273.6087140        0.5681617097E-04 after     43 steps, step:  0.90251E-03
 mylbfgs> Energy and RMS force=    -273.6087140        0.1850797258E-04 after     44 steps, step:  0.41814E-03
 mylbfgs> Energy and RMS force=    -273.6087140        0.1342892949E-04 after     45 steps, step:  0.14677E-03
 mylbfgs> Energy and RMS force=    -273.6087141        0.2446873704E-04 after     46 steps, step:  0.72698E-03
 mylbfgs> Energy and RMS force=    -273.6087141        0.3199390629E-04 after     47 steps, step:  0.10573E-02
 mylbfgs> Energy and RMS force=    -273.6087142        0.3909146997E-04 after     48 steps, step:  0.25249E-02
 mylbfgs> Energy and RMS force=    -273.6087145        0.5196627749E-04 after     49 steps, step:  0.76723E-02
 mylbfgs> Energy and RMS force=    -273.6087148        0.1473701527E-03 after     50 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087155        0.9659261261E-04 after     51 steps, step:  0.13506E-01
 mylbfgs> Energy and RMS force=    -273.6087166        0.1126503052E-03 after     52 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087175        0.1419520984E-03 after     53 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087186        0.1406691080E-03 after     54 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087192        0.1910036789E-03 after     55 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087203        0.1320276205E-03 after     56 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087209        0.1839484524E-03 after     57 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087221        0.1686207737E-03 after     58 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087233        0.1617024228E-03 after     59 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087245        0.1550645339E-03 after     60 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087255        0.2217302958E-03 after     61 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087270        0.1340543414E-03 after     62 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087276        0.2116429139E-03 after     63 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087287        0.1866969122E-03 after     64 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087299        0.1611149168E-03 after     65 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087311        0.1364361746E-03 after     66 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087319        0.1783727016E-03 after     67 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087333        0.1676752949E-03 after     68 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087340        0.1825717253E-03 after     69 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087355        0.1796969770E-03 after     70 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087375        0.2234536719E-03 after     71 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087400        0.2164526254E-03 after     72 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087428        0.2503010795E-03 after     73 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087457        0.3061290628E-03 after     74 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087490        0.2775328864E-03 after     75 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087511        0.3516414721E-03 after     76 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087550        0.3215566135E-03 after     77 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087575        0.3374050364E-03 after     78 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087606        0.3198328808E-03 after     79 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087637        0.4056483629E-03 after     80 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087668        0.3575468993E-03 after     81 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087703        0.2940159491E-03 after     82 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087731        0.2952395810E-03 after     83 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087766        0.2184872811E-03 after     84 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087786        0.3128383878E-03 after     85 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087815        0.2672687120E-03 after     86 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087841        0.2580678731E-03 after     87 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087860        0.2408905356E-03 after     88 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087881        0.1690618585E-03 after     89 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087897        0.1330127431E-03 after     90 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087909        0.1836027940E-03 after     91 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087916        0.1297330146E-03 after     92 steps, step:  0.10022E-01
 mylbfgs> Energy and RMS force=    -273.6087919        0.2674189805E-03 after     93 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087926        0.1113187241E-03 after     94 steps, step:  0.10389E-01
 mylbfgs> Energy and RMS force=    -273.6087929        0.7800586362E-04 after     95 steps, step:  0.11685E-02
 mylbfgs> Energy and RMS force=    -273.6087934        0.8367515979E-04 after     96 steps, step:  0.82591E-02
 mylbfgs> Energy and RMS force=    -273.6087940        0.1197511963E-03 after     97 steps, step:  0.13561E-01
 mylbfgs> Energy and RMS force=    -273.6087951        0.1637587587E-03 after     98 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087962        0.2047782588E-03 after     99 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087978        0.2278110431E-03 after    100 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087997        0.2457627080E-03 after    101 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6088019        0.2510504820E-03 after    102 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6088044        0.2449315737E-03 after    103 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6088069        0.2565395625E-03 after    104 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6088099        0.2089000414E-03 after    105 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6088119        0.2530315387E-03 after    106 steps, step:  0.20000E-01
 mylbfgs> Resetting LBFGS routine - step scaling factor was     0.8058557986E-01
 mylbfgs> Energy and RMS force=    -273.6088119        0.2529428747E-03 after    107 steps, step:  0.28811E-06
 mylbfgs> Energy and RMS force=    -273.6088128        0.9353706007E-04 after    108 steps, step:  0.10010E-02
 mylbfgs> Energy and RMS force=    -273.6088130        0.9197743427E-04 after    109 steps, step:  0.33436E-03
 mylbfgs> Energy and RMS force=    -273.6088137        0.1223253279E-03 after    110 steps, step:  0.25120E-02
 mylbfgs> Energy and RMS force=    -273.6088142        0.2361101449E-03 after    111 steps, step:  0.31827E-02
 mylbfgs> Energy and RMS force=    -273.6088147        0.9472244148E-04 after    112 steps, step:  0.15781E-02
 mylbfgs> Energy and RMS force=    -273.6088149        0.7716528140E-04 after    113 steps, step:  0.74556E-03
 mylbfgs> Energy and RMS force=    -273.6088151        0.8333478148E-04 after    114 steps, step:  0.12733E-02
 mylbfgs> Energy and RMS force=    -273.6088153        0.1432628607E-03 after    115 steps, step:  0.19386E-02
 mylbfgs> Energy and RMS force=    -273.6088155        0.6902097557E-04 after    116 steps, step:  0.11761E-02
 mylbfgs> Energy and RMS force=    -273.6088157        0.7049425988E-04 after    117 steps, step:  0.10396E-02
 mylbfgs> Energy and RMS force=    -273.6088159        0.9853034954E-04 after    118 steps, step:  0.17873E-02
 mylbfgs> Energy and RMS force=    -273.6088162        0.1302814486E-03 after    119 steps, step:  0.27382E-02
 mylbfgs> Energy and RMS force=    -273.6088164        0.8838418797E-04 after    120 steps, step:  0.32078E-02
 mylbfgs> Energy and RMS force=    -273.6088165        0.4627878273E-04 after    121 steps, step:  0.40741E-03
 mylbfgs> Energy and RMS force=    -273.6088166        0.5721642308E-04 after    122 steps, step:  0.58888E-03
 mylbfgs> Energy and RMS force=    -273.6088167        0.6686619979E-04 after    123 steps, step:  0.93822E-03
 mylbfgs> Energy and RMS force=    -273.6088170        0.1388004906E-03 after    124 steps, step:  0.37851E-02
 mylbfgs> Energy and RMS force=    -273.6088173        0.1041802772E-03 after    125 steps, step:  0.47877E-02
 mylbfgs> Energy and RMS force=    -273.6088176        0.7319003130E-04 after    126 steps, step:  0.21473E-02
 mylbfgs> Energy and RMS force=    -273.6088179        0.9660590843E-04 after    127 steps, step:  0.47937E-02
 mylbfgs> Energy and RMS force=    -273.6088182        0.1034874660E-03 after    128 steps, step:  0.31213E-02
 mylbfgs> Energy and RMS force=    -273.6088184        0.9316143505E-04 after    129 steps, step:  0.32268E-02
 mylbfgs> Energy and RMS force=    -273.6088190        0.8549873715E-04 after    130 steps, step:  0.66837E-02
 mylbfgs> Energy and RMS force=    -273.6088193        0.1462520831E-03 after    131 steps, step:  0.77417E-02
 mylbfgs> Energy and RMS force=    -273.6088197        0.9237755388E-04 after    132 steps, step:  0.35614E-02
 mylbfgs> Energy and RMS force=    -273.6088202        0.8533694245E-04 after    133 steps, step:  0.54300E-02
 mylbfgs> Energy and RMS force=    -273.6088207        0.8456154864E-04 after    134 steps, step:  0.70063E-02
 mylbfgs> Energy and RMS force=    -273.6088210        0.1440831600E-03 after    135 steps, step:  0.94395E-02
 mylbfgs> Energy and RMS force=    -273.6088213        0.5526577708E-04 after    136 steps, step:  0.41419E-02
 mylbfgs> Energy and RMS force=    -273.6088215        0.5498806754E-04 after    137 steps, step:  0.11845E-02
 mylbfgs> Energy and RMS force=    -273.6088220        0.9167888630E-04 after    138 steps, step:  0.34684E-02
 mylbfgs> Energy and RMS force=    -273.6088227        0.1269737904E-03 after    139 steps, step:  0.82124E-02
 mylbfgs> Energy and RMS force=    -273.6088232        0.1536408570E-03 after    140 steps, step:  0.16691E-01
 mylbfgs> Energy and RMS force=    -273.6088238        0.7740841423E-04 after    141 steps, step:  0.64439E-02
 mylbfgs> Energy and RMS force=    -273.6088243        0.8167371171E-04 after    142 steps, step:  0.13285E-01
 mylbfgs> Energy and RMS force=    -273.6088247        0.9796618371E-04 after    143 steps, step:  0.10727E-01
 mylbfgs> Energy and RMS force=    -273.6088255        0.1310683615E-03 after    144 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6088261        0.7248924239E-04 after    145 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6088262        0.1498407303E-03 after    146 steps, step:  0.93369E-02
 mylbfgs> Energy and RMS force=    -273.6088266        0.7055630536E-04 after    147 steps, step:  0.23706E-02
 mylbfgs> Energy and RMS force=    -273.6088269        0.7196509427E-04 after    148 steps, step:  0.41710E-02
 mylbfgs> Energy and RMS force=    -273.6088271        0.9964286257E-04 after    149 steps, step:  0.50130E-02
 mylbfgs> Energy and RMS force=    -273.6088275        0.1125135628E-03 after    150 steps, step:  0.37645E-02
 mylbfgs> Energy and RMS force=    -273.6088282        0.1182463519E-03 after    151 steps, step:  0.11147E-01
 mylbfgs> Energy and RMS force=    -273.6088284        0.2192265051E-03 after    152 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6088291        0.7818939967E-04 after    153 steps, step:  0.31582E-02
 mylbfgs> Energy and RMS force=    -273.6088295        0.5645172993E-04 after    154 steps, step:  0.13050E-01
 mylbfgs> Energy and RMS force=    -273.6088299        0.5457193206E-04 after    155 steps, step:  0.18760E-01
 mylbfgs> Energy and RMS force=    -273.6088305        0.5657935170E-04 after    156 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6088313        0.5915662212E-04 after    157 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6088321        0.6956059450E-04 after    158 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6088332        0.7768129920E-04 after    159 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6088345        0.1164207497E-03 after    160 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6088358        0.1310528201E-03 after    161 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6088376        0.1281999561E-03 after    162 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6088389        0.1498928564E-03 after    163 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6088407        0.1319259577E-03 after    164 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6088418        0.2583146537E-03 after    165 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6088433        0.1943472462E-03 after    166 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6088445        0.1355455292E-03 after    167 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6088449        0.8207553113E-04 after    168 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6088451        0.5025785198E-04 after    169 steps, step:  0.30836E-02
 mylbfgs> Energy and RMS force=    -273.6088451        0.5340149127E-04 after    170 steps, step:  0.56385E-02
 mylbfgs> Energy and RMS force=    -273.6088452        0.3430064918E-04 after    171 steps, step:  0.47612E-03
 mylbfgs> Energy and RMS force=    -273.6088453        0.4457110261E-04 after    172 steps, step:  0.22342E-02
 mylbfgs> Energy and RMS force=    -273.6088454        0.7165724067E-04 after    173 steps, step:  0.20362E-02
 mylbfgs> Energy and RMS force=    -273.6088455        0.3873308592E-04 after    174 steps, step:  0.18459E-02
 mylbfgs> Energy and RMS force=    -273.6088455        0.3308732572E-04 after    175 steps, step:  0.19172E-02
 mylbfgs> Energy and RMS force=    -273.6088456        0.4705384574E-04 after    176 steps, step:  0.27722E-02
 mylbfgs> Energy and RMS force=    -273.6088457        0.7671235699E-04 after    177 steps, step:  0.80092E-02
 mylbfgs> Energy and RMS force=    -273.6088460        0.1072253914E-03 after    178 steps, step:  0.16509E-01
 mylbfgs> Energy and RMS force=    -273.6088463        0.1877736867E-03 after    179 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6088467        0.1095147036E-03 after    180 steps, step:  0.14517E-01
 mylbfgs> Energy and RMS force=    -273.6088472        0.5153733115E-04 after    181 steps, step:  0.18052E-01
 mylbfgs> Energy and RMS force=    -273.6088474        0.8100228544E-04 after    182 steps, step:  0.19425E-01
 mylbfgs> Energy and RMS force=    -273.6088472        0.2204363872E-03 after    183 steps, step:  0.65243E-02
 mylbfgs> Energy and RMS force=    -273.6088477        0.9801022651E-04 after    184 steps, step:  0.14805E-01
 mylbfgs> Energy and RMS force=    -273.6088479        0.5121512500E-04 after    185 steps, step:  0.13090E-02
 mylbfgs> Energy and RMS force=    -273.6088481        0.3445167894E-04 after    186 steps, step:  0.12395E-01
 mylbfgs> Energy and RMS force=    -273.6088483        0.5447373032E-04 after    187 steps, step:  0.41516E-02
 mylbfgs> Energy and RMS force=    -273.6088483        0.3563659157E-04 after    188 steps, step:  0.13081E-01
 mylbfgs> Energy and RMS force=    -273.6088484        0.5891235984E-04 after    189 steps, step:  0.27713E-02
 mylbfgs> Energy and RMS force=    -273.6088484        0.5582200263E-04 after    190 steps, step:  0.37542E-02
 mylbfgs> Energy and RMS force=    -273.6088485        0.4795525306E-04 after    191 steps, step:  0.51149E-02
 mylbfgs> Energy and RMS force=    -273.6088486        0.4434907285E-04 after    192 steps, step:  0.40337E-02
 mylbfgs> Energy and RMS force=    -273.6088487        0.5408017602E-04 after    193 steps, step:  0.63958E-02
 mylbfgs> Energy and RMS force=    -273.6088488        0.3928640067E-04 after    194 steps, step:  0.47066E-02
 mylbfgs> Energy and RMS force=    -273.6088489        0.3801092016E-04 after    195 steps, step:  0.43444E-02
 mylbfgs> Energy and RMS force=    -273.6088490        0.4063323397E-04 after    196 steps, step:  0.39829E-02
 mylbfgs> Energy and RMS force=    -273.6088490        0.1027748590E-03 after    197 steps, step:  0.52840E-02
 mylbfgs> Energy and RMS force=    -273.6088491        0.3487692662E-04 after    198 steps, step:  0.16796E-02
 mylbfgs> Energy and RMS force=    -273.6088492        0.2829016441E-04 after    199 steps, step:  0.21508E-02
 mylbfgs> Energy and RMS force=    -273.6088493        0.3181903079E-04 after    200 steps, step:  0.38810E-02
 mylbfgs> Energy and RMS force=    -273.6088493        0.3210712654E-04 after    201 steps, step:  0.34891E-02
 mylbfgs> Energy and RMS force=    -273.6088493        0.6562218051E-04 after    202 steps, step:  0.48449E-02
 mylbfgs> Energy and RMS force=    -273.6088494        0.2000990631E-04 after    203 steps, step:  0.17238E-02
 mylbfgs> Energy and RMS force=    -273.6088494        0.1665990158E-04 after    204 steps, step:  0.37158E-03
 mylbfgs> Energy and RMS force=    -273.6088494        0.1864787395E-04 after    205 steps, step:  0.30861E-02
 mylbfgs> Energy and RMS force=    -273.6088495        0.2169637321E-04 after    206 steps, step:  0.30068E-02
 mylbfgs> Energy and RMS force=    -273.6088495        0.2863693625E-04 after    207 steps, step:  0.75026E-02
 mylbfgs> Energy and RMS force=    -273.6088495        0.1737483543E-04 after    208 steps, step:  0.21204E-02
 mylbfgs> Energy and RMS force=    -273.6088495        0.1246722227E-04 after    209 steps, step:  0.70994E-03
 mylbfgs> Energy and RMS force=    -273.6088495        0.5836503424E-05 after    210 steps, step:  0.12621E-02
 mylbfgs> Diagonal inverse Hessian elements are now         2.0023072271
 mylbfgs> Final energy is   -273.60884953598003    
 Plus  side of path:                     211 steps. Energy=    -273.6088495       time=       0.74
 golden> golden a, b, c, d=     0.000000000       -0.1000000000       -0.3819660113E-01   -0.6180339887E-01 initially
 golden> energy at ts, C and D and diff=    -273.606895971683        -273.606938828945        -273.606998346046       -0.102374362995761E-03
 golden> energy at ts, C and D and diff=    -273.606895971683        -273.606998345973        -273.607041568896       -0.145597213020210E-03
 golden> energy at ts, C and D and diff=    -273.606895971683        -273.607041568745        -273.607068829156       -0.172857472989563E-03
 golden> energy at ts, C and D and diff=    -273.606895971683        -273.607068829102        -273.607085362307       -0.189390623972940E-03
 golden> energy at ts, C and D and diff=    -273.606895971683        -273.607085362088        -273.607095324965       -0.199353281971071E-03
 golden> energy at ts, C and D and diff=    -273.606895971683        -273.607095324881        -273.607101351191       -0.205379507974612E-03
 golden> energy at ts, C and D and diff=    -273.606895971683        -273.607101350992        -273.607105017424       -0.209045740973579E-03
 golden> energy at ts, C and D and diff=    -273.606895971683        -273.607105017309        -273.607107258928       -0.211287245008407E-03
 golden> energy at ts, C and D and diff=    -273.606895971683        -273.607107258819        -273.607108634465       -0.212662782018924E-03
 golden> energy at ts, C and D and diff=    -273.606895971683        -273.607108634403        -273.607109480805       -0.213509121977040E-03
 path> golden section - pushoff, energy, delta, step:     -273.607109480805       -0.213509121977040E-03   -0.995934690628392E-01
 mylbfgs> Resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6071097        0.6478295181E-03 after      0 steps
 mylbfgs> Energy and RMS force=    -273.6071097        0.6475740013E-03 after      1 steps, step:  0.18886E-05
 mylbfgs> Energy and RMS force=    -273.6071329        0.5571209703E-03 after      2 steps, step:  0.76932E-02
 mylbfgs> Energy and RMS force=    -273.6071580        0.9526835130E-03 after      3 steps, step:  0.12589E-01
 mylbfgs> Energy and RMS force=    -273.6071904        0.1232107961E-02 after      4 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6072146        0.1189233771E-02 after      5 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6072309        0.6446137884E-03 after      6 steps, step:  0.13676E-01
 mylbfgs> Energy and RMS force=    -273.6072396        0.3277379607E-03 after      7 steps, step:  0.47369E-02
 mylbfgs> Energy and RMS force=    -273.6072422        0.2799114675E-03 after      8 steps, step:  0.44445E-02
 mylbfgs> Energy and RMS force=    -273.6072443        0.2520450553E-03 after      9 steps, step:  0.20286E-02
 mylbfgs> Energy and RMS force=    -273.6072496        0.3555754993E-03 after     10 steps, step:  0.94903E-02
 mylbfgs> Energy and RMS force=    -273.6072502        0.7876233591E-03 after     11 steps, step:  0.77684E-02
 mylbfgs> Energy and RMS force=    -273.6072538        0.3412424992E-03 after     12 steps, step:  0.14740E-02
 mylbfgs> Energy and RMS force=    -273.6072564        0.2315509929E-03 after     13 steps, step:  0.25223E-02
 mylbfgs> Energy and RMS force=    -273.6072605        0.3370233006E-03 after     14 steps, step:  0.81133E-02
 mylbfgs> Energy and RMS force=    -273.6072635        0.2637427235E-03 after     15 steps, step:  0.87922E-02
 mylbfgs> Energy and RMS force=    -273.6072643        0.3425337615E-03 after     16 steps, step:  0.72095E-02
 mylbfgs> Energy and RMS force=    -273.6072654        0.9799377281E-04 after     17 steps, step:  0.19890E-02
 mylbfgs> Energy and RMS force=    -273.6072656        0.7111024883E-04 after     18 steps, step:  0.11462E-02
 mylbfgs> Energy and RMS force=    -273.6072658        0.6566984532E-04 after     19 steps, step:  0.13904E-02
 mylbfgs> Energy and RMS force=    -273.6072662        0.2003758764E-03 after     20 steps, step:  0.41204E-02
 mylbfgs> Energy and RMS force=    -273.6072665        0.5245624615E-04 after     21 steps, step:  0.10613E-02
 mylbfgs> Energy and RMS force=    -273.6072666        0.2700140071E-04 after     22 steps, step:  0.79152E-03
 mylbfgs> Energy and RMS force=    -273.6072666        0.2801217478E-04 after     23 steps, step:  0.49634E-03
 mylbfgs> Energy and RMS force=    -273.6072666        0.5119497409E-04 after     24 steps, step:  0.70876E-03
 mylbfgs> Energy and RMS force=    -273.6072667        0.4407179434E-04 after     25 steps, step:  0.64701E-03
 mylbfgs> Energy and RMS force=    -273.6072668        0.3645217457E-04 after     26 steps, step:  0.14308E-02
 mylbfgs> Energy and RMS force=    -273.6072668        0.8409270037E-04 after     27 steps, step:  0.15610E-02
 mylbfgs> Energy and RMS force=    -273.6072669        0.2830104284E-04 after     28 steps, step:  0.36363E-03
 mylbfgs> Energy and RMS force=    -273.6072669        0.2397440878E-04 after     29 steps, step:  0.23597E-03
 mylbfgs> Energy and RMS force=    -273.6072669        0.3157702087E-04 after     30 steps, step:  0.64921E-03
 mylbfgs> Energy and RMS force=    -273.6072670        0.3793300886E-04 after     31 steps, step:  0.12667E-02
 mylbfgs> Energy and RMS force=    -273.6072671        0.3387075216E-04 after     32 steps, step:  0.22508E-02
 mylbfgs> Energy and RMS force=    -273.6072669        0.1567665766E-03 after     33 steps, step:  0.23630E-02
 mylbfgs> Energy and RMS force=    -273.6072671        0.1307705527E-04 after     34 steps, step:  0.15218E-02
 mylbfgs> Energy and RMS force=    -273.6072671        0.1043834446E-04 after     35 steps, step:  0.69650E-04
 mylbfgs> Energy and RMS force=    -273.6072671        0.1747744448E-04 after     36 steps, step:  0.33870E-03
 mylbfgs> Energy and RMS force=    -273.6072671        0.2432034494E-04 after     37 steps, step:  0.45477E-03
 mylbfgs> Energy and RMS force=    -273.6072672        0.2889135139E-04 after     38 steps, step:  0.12398E-02
 mylbfgs> Energy and RMS force=    -273.6072672        0.3014082417E-04 after     39 steps, step:  0.21302E-02
 mylbfgs> Energy and RMS force=    -273.6072673        0.1142580859E-03 after     40 steps, step:  0.10007E-01
 mylbfgs> Energy and RMS force=    -273.6072675        0.3688126633E-04 after     41 steps, step:  0.39275E-02
 mylbfgs> Energy and RMS force=    -273.6072677        0.4421706080E-04 after     42 steps, step:  0.48158E-02
 mylbfgs> Energy and RMS force=    -273.6072682        0.9080589772E-04 after     43 steps, step:  0.17714E-01
 mylbfgs> Energy and RMS force=    -273.6072685        0.9605948083E-04 after     44 steps, step:  0.16400E-01
 mylbfgs> Energy and RMS force=    -273.6072689        0.1009076267E-03 after     45 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6072692        0.8884851861E-04 after     46 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6072694        0.3638144347E-04 after     47 steps, step:  0.60160E-02
 mylbfgs> Energy and RMS force=    -273.6072695        0.1834861153E-04 after     48 steps, step:  0.81165E-03
 mylbfgs> Energy and RMS force=    -273.6072695        0.1877531434E-04 after     49 steps, step:  0.56611E-02
 mylbfgs> Energy and RMS force=    -273.6072695        0.5044733999E-04 after     50 steps, step:  0.58479E-02
 mylbfgs> Energy and RMS force=    -273.6072696        0.2625830822E-04 after     51 steps, step:  0.71460E-02
 mylbfgs> Energy and RMS force=    -273.6072696        0.1682413305E-04 after     52 steps, step:  0.32235E-02
 mylbfgs> Energy and RMS force=    -273.6072697        0.1927674124E-04 after     53 steps, step:  0.10353E-02
 mylbfgs> Energy and RMS force=    -273.6072698        0.3141677755E-04 after     54 steps, step:  0.27114E-02
 mylbfgs> Energy and RMS force=    -273.6072699        0.7279287533E-04 after     55 steps, step:  0.46278E-02
 mylbfgs> Energy and RMS force=    -273.6072700        0.4739990600E-04 after     56 steps, step:  0.29294E-02
 mylbfgs> Energy and RMS force=    -273.6072702        0.4641025590E-04 after     57 steps, step:  0.57158E-02
 mylbfgs> Energy and RMS force=    -273.6072703        0.1677453948E-03 after     58 steps, step:  0.11884E-01
 mylbfgs> Energy and RMS force=    -273.6072705        0.6419715992E-04 after     59 steps, step:  0.31696E-02
 mylbfgs> Energy and RMS force=    -273.6072707        0.6493018911E-04 after     60 steps, step:  0.85024E-02
 mylbfgs> Energy and RMS force=    -273.6072709        0.1051970129E-03 after     61 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6072713        0.1178380827E-03 after     62 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6072716        0.1301515161E-03 after     63 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6072720        0.8711990362E-04 after     64 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6072721        0.1151830151E-03 after     65 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6072724        0.7621956276E-04 after     66 steps, step:  0.29174E-02
 mylbfgs> Energy and RMS force=    -273.6072724        0.5648045842E-04 after     67 steps, step:  0.37669E-02
 mylbfgs> Energy and RMS force=    -273.6072725        0.3430841191E-04 after     68 steps, step:  0.61332E-02
 mylbfgs> Energy and RMS force=    -273.6072725        0.2254284026E-04 after     69 steps, step:  0.63614E-02
 mylbfgs> Energy and RMS force=    -273.6072725        0.2655621846E-04 after     70 steps, step:  0.15265E-02
 mylbfgs> Energy and RMS force=    -273.6072725        0.1889361837E-04 after     71 steps, step:  0.47701E-03
 mylbfgs> Energy and RMS force=    -273.6072726        0.1512078183E-04 after     72 steps, step:  0.79353E-03
 mylbfgs> Energy and RMS force=    -273.6072726        0.1787969049E-04 after     73 steps, step:  0.15710E-02
 mylbfgs> Energy and RMS force=    -273.6072726        0.5174581377E-04 after     74 steps, step:  0.10992E-02
 mylbfgs> Energy and RMS force=    -273.6072726        0.9172916938E-05 after     75 steps, step:  0.15548E-02
 mylbfgs> Diagonal inverse Hessian elements are now         0.4902707610
 mylbfgs> Final energy is   -273.60727260012499    
 Minus side of path:                      76 steps. Energy=    -273.6072726       time=       0.25
 path> number of entries in EofS file=   288
 Frames will be dumped to path.xyz with probability     0.4762/    1.0000 steps on the plus/minus sides
 Transition state will be frame number     22

         E+        Ets - E+           Ets       Ets - E-           E-          S       D      gamma   ~N
     -273.6088495 0.19536E-02     -273.6068960 0.37663E-03     -273.6072726   2.920   1.746   2.195   6.835
 minpermdist> initial energy for structure A=                  -273.607272600018007 RMS=        0.000009173184534
 minpermdist> initial energy for structure B=                  -273.607272188929016 RMS=        0.000010912119418
isnewmin> minimum distance=    0.5229714108E-01
isnewmin> MINPOS=     2
 orca_subp> ORCA numerical Hessian calculation
 orca_subp> ORCA numerical Hessian calculation
 orca_subp> ORCA numerical Hessian calculation
        *NEW* (Placed in 4)                                     Known (#2)
 minpermdist> initial energy for structure A=                  -273.608849535987019 RMS=        0.000005846838457
 minpermdist> initial energy for structure B=                  -273.615151023390979 RMS=        0.000008852857057
 addnewmin> distance from MINPERMDIST/NEWMINDIST=     2.696380069     for      1 and      4
 minpermdist> initial energy for structure A=                  -273.608849385342012 RMS=        0.000005893232836
 minpermdist> initial energy for structure B=                  -273.607272188809020 RMS=        0.000010912366081
 addnewmin> distance from MINPERMDIST/NEWMINDIST=     1.735810076     for      2 and      4
 minpermdist> initial energy for structure A=                  -273.608849129628027 RMS=        0.000005925150342
 minpermdist> initial energy for structure B=                  -273.609160568112998 RMS=        0.000011131765349
 minpermdist> WARNING *** RMS for structure B is outside tolerance - QCI/DNEB endpoint alignment?
 addnewmin> distance from MINPERMDIST/NEWMINDIST=     1.426611045     for      3 and      4
 Unconnected minimum 4 found its way to F set.
 >>>>>>>>>>>>>>>>>>>>> CONNECT CYCLE 3 >>>>>>>>>>>>>>>>>>>>> 4 minima and 2 ts are known >>>>>>>>>>>>>>>>>>>>
 decide> Shortest path in Dijkstra has      3 steps with      1 missing connections, weight=     2.0352    
 decide> The unconnected minima in the chain and their distances are:
     4        1.43     3 
 
 minpermdist> initial energy for structure A=                  -273.608849337507991 RMS=        0.000005821194600
 minpermdist> initial energy for structure B=                  -273.609160568151026 RMS=        0.000011131795876
 minpermdist> WARNING *** RMS for structure B is outside tolerance - QCI/DNEB endpoint alignment?

 tryconnect> Interpolation for minima 3_S and 4_F using 1 initial images  (interp attempt set to #1)  ...
 intlbfgs> extra distance before turning on constraint potential is initially     0.200000
 intlbfgs> End minima distance=     1.426611045     density      50.00000000     images set to                    1
 intlbfgs> Maximum number of steps for constraint potential phase is 300000
 intlbfgs> Updates:      4 maximum step size=    0.2000000000    
 intlbfgs> Total number of atoms moving less than threshold=     0
 intlbfgs> Total distance constraints=     9 shortest=        1.01302 longest=        1.78315
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       2 disconnected=      11
 checkperc> increasing the local constraint tolerance parameter to         0.00110
 intlbfgs> Total distance constraints=    10 shortest=        1.01302 longest=        2.66249
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       2 disconnected=      10
 checkperc> increasing the local constraint tolerance parameter to         0.00121
 intlbfgs> Total distance constraints=    11 shortest=        1.01302 longest=        2.66249
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       2 disconnected=      10
 checkperc> increasing the local constraint tolerance parameter to         0.00133
 intlbfgs> Total distance constraints=    11 shortest=        1.01302 longest=        2.66249
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       2 disconnected=      10
 checkperc> increasing the local constraint tolerance parameter to         0.00146
 intlbfgs> Total distance constraints=    12 shortest=        1.01302 longest=        2.66249
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       2 disconnected=      10
 checkperc> increasing the local constraint tolerance parameter to         0.00161
 intlbfgs> Total distance constraints=    12 shortest=        1.01302 longest=        2.66249
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       2 disconnected=      10
 checkperc> increasing the local constraint tolerance parameter to         0.00177
 intlbfgs> Total distance constraints=    13 shortest=        1.01302 longest=        2.66249
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       2 disconnected=      10
 checkperc> increasing the local constraint tolerance parameter to         0.00195
 intlbfgs> Total distance constraints=    13 shortest=        1.01302 longest=        2.66249
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       2 disconnected=      10
 checkperc> increasing the local constraint tolerance parameter to         0.00214
 intlbfgs> Total distance constraints=    13 shortest=        1.01302 longest=        2.66249
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       2 disconnected=      10
 checkperc> increasing the local constraint tolerance parameter to         0.00236
 intlbfgs> Total distance constraints=    14 shortest=        1.01302 longest=        2.66249
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       2 disconnected=      10
 checkperc> increasing the local constraint tolerance parameter to         0.00259
 intlbfgs> Total distance constraints=    15 shortest=        1.01302 longest=        2.66249
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       4 disconnected=       6
 checkperc> increasing the local constraint tolerance parameter to         0.00285
 intlbfgs> Total distance constraints=    17 shortest=        1.01302 longest=        2.66249
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       4 disconnected=       6
 checkperc> increasing the local constraint tolerance parameter to         0.00314
 intlbfgs> Total distance constraints=    18 shortest=        1.01302 longest=        2.66249
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       4 disconnected=       6
 checkperc> increasing the local constraint tolerance parameter to         0.00345
 intlbfgs> Total distance constraints=    19 shortest=        1.01302 longest=        2.66249
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       4 disconnected=       6
 checkperc> increasing the local constraint tolerance parameter to         0.00380
 intlbfgs> Total distance constraints=    19 shortest=        1.01302 longest=        2.66249
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       4 disconnected=       6
 checkperc> increasing the local constraint tolerance parameter to         0.00418
 intlbfgs> Total distance constraints=    19 shortest=        1.01302 longest=        2.66249
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       4 disconnected=       6
 checkperc> increasing the local constraint tolerance parameter to         0.00459
 intlbfgs> Total distance constraints=    19 shortest=        1.01302 longest=        2.66249
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       4 disconnected=       6
 checkperc> increasing the local constraint tolerance parameter to         0.00505
 intlbfgs> Total distance constraints=    20 shortest=        1.01302 longest=        2.81084
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       4 disconnected=       6
 checkperc> increasing the local constraint tolerance parameter to         0.00556
 intlbfgs> Total distance constraints=    21 shortest=        1.01302 longest=        2.81084
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       4 disconnected=       6
 checkperc> increasing the local constraint tolerance parameter to         0.00612
 intlbfgs> Total distance constraints=    22 shortest=        1.01302 longest=        2.81084
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       4 disconnected=       6
 checkperc> increasing the local constraint tolerance parameter to         0.00673
 intlbfgs> Total distance constraints=    22 shortest=        1.01302 longest=        2.81084
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       4 disconnected=       6
 checkperc> increasing the local constraint tolerance parameter to         0.00740
 intlbfgs> Total distance constraints=    24 shortest=        1.01302 longest=        2.81084
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       4 disconnected=       1
 checkperc> increasing the local constraint tolerance parameter to         0.00814
 intlbfgs> Total distance constraints=    24 shortest=        1.01302 longest=        2.81084
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       4 disconnected=       1
 checkperc> increasing the local constraint tolerance parameter to         0.00895
 intlbfgs> Total distance constraints=    26 shortest=        1.01302 longest=        4.29496
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       3 disconnected=       1
 checkperc> increasing the local constraint tolerance parameter to         0.00985
 intlbfgs> Total distance constraints=    27 shortest=        1.01302 longest=        5.00198
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       3 disconnected=       1
 checkperc> increasing the local constraint tolerance parameter to         0.01083
 intlbfgs> Total distance constraints=    27 shortest=        1.01302 longest=        5.00198
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       3 disconnected=       1
 checkperc> increasing the local constraint tolerance parameter to         0.01192
 intlbfgs> Total distance constraints=    27 shortest=        1.01302 longest=        5.00198
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       3 disconnected=       1
 checkperc> increasing the local constraint tolerance parameter to         0.01311
 intlbfgs> Total distance constraints=    28 shortest=        1.01302 longest=        5.00198
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       3 disconnected=       1
 checkperc> increasing the local constraint tolerance parameter to         0.01442
 intlbfgs> Total distance constraints=    29 shortest=        1.01302 longest=        5.00198
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       3 disconnected=       1
 checkperc> increasing the local constraint tolerance parameter to         0.01586
 intlbfgs> Total distance constraints=    31 shortest=        1.01302 longest=        5.03978
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       3 disconnected=       1
 checkperc> increasing the local constraint tolerance parameter to         0.01745
 intlbfgs> Total distance constraints=    31 shortest=        1.01302 longest=        5.03978
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       3 disconnected=       1
 checkperc> increasing the local constraint tolerance parameter to         0.01919
 intlbfgs> Total distance constraints=    34 shortest=        1.01302 longest=        5.03978
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       3 disconnected=       1
 checkperc> increasing the local constraint tolerance parameter to         0.02111
 intlbfgs> Total distance constraints=    35 shortest=        1.01302 longest=        5.27967
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       3 disconnected=       1
 checkperc> increasing the local constraint tolerance parameter to         0.02323
 intlbfgs> Total distance constraints=    36 shortest=        1.01302 longest=        5.27967
 checkperc> steps to atom 1 converged in        2 cycles; maximum=       3 disconnected=       0
           5
           8
 intlbfgs> maximum constraints      8 for atom      2
 intlbfgs> largest number of common constraint atoms for any group is:     -1
 intlbfgs> Smallest overall motion for constraint     12 atoms      2    14 distance=        0.25883
 intlbfgs> Largest overall motion for constraint      34 atoms     12    13 distance=        0.93677
 intlbfgs> Turning on constraint     12 for atoms      2    14
 intlbfgs> Number of active atoms is now      2
 intlbfgs> constrained potential finished, time=       0.0 number of repulsions=     0
 checkrep> number of active repulsions and total=       0       0
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.9193138710E-01    0.5551115123E-14
 intlbfgs> largest atomic distance between images is     0.7092064252E-01 for atom     14 and images      2     3 total images=     1
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.9193138710E-01    0.5551115123E-14
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:      1   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.4389441194E-18         2     3
 intlbfgs> largest atomic distance between images is     0.7092064252E-01 for atom     14 and images      1     2 total images=     1
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.9193138710E-01    0.6106226635E-13
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:      2   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.1333423610E-14         2     3
 intlbfgs> Choosing new active atom        6 new constraints=       2 maximum constraints available and possible=       2       2 shortest constraint=        1.01302
 intlbfgs> New active atom      6 closest average distances in endpoints:
    14     2
 intlbfgs> sorted average distances:
   1.013       2.253    
 intlbfgs> New active atom is number      6 total=     3 steps=     3
 intlbfgs> New active atom      6 is constrained to      2 other active atoms:
    14     2
 intlbfgs> sorted distances:
   1.013       2.253    
 intlbfgs> Turning on constraint     25 for atoms      6    14
 intlbfgs> Turning on constraint      8 for atoms      2     6
 checkrep> number of active repulsions and total=       0       0
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.1237882800         0.000000000    
 intlbfgs> energies for constrained, preserved, closest, and linear schemes=    0.10000+101    0.10000+101    0.10000+101     0.0000    
 intlbfgs> lowest energy from linear interpolation
 checkrep> number of active repulsions and total=       0       0
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.1237882800         0.000000000    
 intlbfgs> largest atomic distance between images is     0.8289848211E-01 for atom      6 and images      1     2 total images=     1
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.1237882800        0.1665334537E-13
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:      3   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.1910861581E-14         3     3
 intlbfgs> Choosing new active atom        9 new constraints=       3 maximum constraints available and possible=       3       3 shortest constraint=        1.01355
 intlbfgs> New active atom      9 closest average distances in endpoints:
     6    14     2
 intlbfgs> sorted average distances:
   1.014       1.620       2.835    
 intlbfgs> New active atom is number      9 total=     4 steps=     4
 intlbfgs> New active atom      9 is constrained to      3 other active atoms:
     6    14     2
 intlbfgs> sorted distances:
   1.014       1.620       2.835    
 intlbfgs> Turning on constraint     24 for atoms      6     9
 intlbfgs> Turning on constraint     30 for atoms      9    14
 intlbfgs> Turning on constraint     10 for atoms      2     9
 intlbfgs> initial guess from closest three constrained active atoms,      6    14     2
 checkrep> number of active repulsions and total=       0       0
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.2521680874         2.380895378    
 intlbfgs> energies for constrained, preserved, closest, and linear schemes=     0.0000        0.10000+101    0.10000+101    0.10000+101
 intlbfgs> interpolation using closest constraints
 checkrep> number of active repulsions and total=       0       0
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.2521680874         2.380895378    
 intlbfgs> largest atomic distance between images is     0.2201402783     for atom      9 and images      2     3 total images=     1
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.2517162131        0.3342121895    
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:      4   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.1408827741E-01         4     3
 intlbfgs> Mean deviation     0.3342121895     Decreasing QCI force constant to      2.970297030    
 intlbfgs> Choosing new active atom       15 new constraints=       4 maximum constraints available and possible=       4       4 shortest constraint=        1.01428
 intlbfgs> New active atom     15 closest average distances in endpoints:
     6    14     9     2
 intlbfgs> sorted average distances:
   1.014       1.618       1.628       2.811    
 intlbfgs> New active atom is number     15 total=     5 steps=     5
 intlbfgs> New active atom     15 is constrained to      4 other active atoms:
     6    14     9     2
 intlbfgs> sorted distances:
   1.014       1.618       1.628       2.811    
 intlbfgs> Turning on constraint     26 for atoms      6    15
 intlbfgs> Turning on constraint     36 for atoms     14    15
 intlbfgs> Turning on constraint     31 for atoms      9    15
 intlbfgs> Turning on constraint     13 for atoms      2    15
 intlbfgs> initial guess from closest three constrained active atoms,      6    14     9
 checkrep> number of active repulsions and total=       0       0
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.3278830988         1.669554121    
 intlbfgs> energies for constrained, preserved, closest, and linear schemes=     0.0000        0.10000+101    0.10000+101    0.10000+101
 intlbfgs> interpolation using closest constraints
 checkrep> number of active repulsions and total=       0       0
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.3278830988         1.669554121    
 intlbfgs> largest atomic distance between images is     0.2191738275     for atom      9 and images      2     3 total images=     1
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.3274872902        0.1657022061E-01
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:      5   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.1684313420E-01         5     3
 intlbfgs> Choosing new active atom        3 new constraints=       3 maximum constraints available and possible=       3       3 shortest constraint=        2.04446
 intlbfgs> New active atom      3 closest average distances in endpoints:
     2     6    14    15     9
 intlbfgs> sorted average distances:
   2.044       4.295       4.721       4.770       4.831    
 intlbfgs> New active atom is number      3 total=     6 steps=     6
 intlbfgs> New active atom      3 is constrained to      3 other active atoms:
     2     6    14
 intlbfgs> sorted distances:
   2.044       4.295       4.721    
 intlbfgs> Turning on constraint      6 for atoms      2     3
 intlbfgs> Turning on constraint     15 for atoms      3     6
 intlbfgs> Turning on constraint     19 for atoms      3    14
 intlbfgs> initial guess from closest three constrained active atoms,      2     6    14
 checkrep> number of active repulsions and total=       2       2
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.3565344663         7.482506403    
 intlbfgs> energies for constrained, preserved, closest, and linear schemes=     0.0000        0.10000+101    0.10000+101    0.10000+101
 intlbfgs> interpolation using closest constraints
 checkrep> number of active repulsions and total=       2       2
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.3565344663         7.482506403    
 intlbfgs> largest atomic distance between images is     0.2191642601     for atom      9 and images      1     2 total images=     1
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.3469110579        0.1665334537E-13
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:      6   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.8649418499E-01         6     3
 intlbfgs> Choosing new active atom        8 new constraints=       4 maximum constraints available and possible=       4       4 shortest constraint=        1.08302
 intlbfgs> New active atom      8 closest average distances in endpoints:
     3     2     6    14    15     9
 intlbfgs> sorted average distances:
   1.083       2.662       4.813       5.040       5.323       5.438    
 intlbfgs> New active atom is number      8 total=     7 steps=     7
 intlbfgs> New active atom      8 is constrained to      4 other active atoms:
     3     2     6    14
 intlbfgs> sorted distances:
   1.083       2.662       4.813       5.040    
 intlbfgs> Turning on constraint     17 for atoms      3     8
 intlbfgs> Turning on constraint      9 for atoms      2     8
 intlbfgs> Turning on constraint     23 for atoms      6     8
 intlbfgs> Turning on constraint     29 for atoms      8    14
 intlbfgs> initial guess from closest three constrained active atoms,      3     2     6
 checkrep> number of active repulsions and total=       4       4
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.3955693517         10.07757403    
 intlbfgs> energies for constrained, preserved, closest, and linear schemes=     0.0000        0.10000+101    0.10000+101    0.10000+101
 intlbfgs> interpolation using closest constraints
 checkrep> number of active repulsions and total=       4       4
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.3955693517         10.07757403    
 intlbfgs> largest atomic distance between images is     0.2191642601     for atom      9 and images      1     2 total images=     1
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.3591173508        0.5551115123E-14
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:      7   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.1705841799             7     3
 intlbfgs> Choosing new active atom        1 new constraints=       3 maximum constraints available and possible=       3       3 shortest constraint=        1.08928
 intlbfgs> New active atom      1 closest average distances in endpoints:
     3     8     2     6     9    14    15
 intlbfgs> sorted average distances:
   1.089       1.767       2.622       4.799       5.143       5.280       5.372    
 intlbfgs> New active atom is number      1 total=     8 steps=     8
 intlbfgs> New active atom      1 is constrained to      3 other active atoms:
     3     8    14
 intlbfgs> sorted distances:
   1.089       1.767       5.280    
 intlbfgs> Turning on constraint      1 for atoms      1     3
 intlbfgs> Turning on constraint      4 for atoms      1     8
 intlbfgs> Turning on constraint      5 for atoms      1    14
 intlbfgs> initial guess from closest three constrained active atoms,      3     8    14
 checkrep> number of active repulsions and total=       8       8
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.3983661784         2.267691205    
 intlbfgs> energies for constrained, preserved, closest, and linear schemes=     0.0000        0.10000+101    0.10000+101    0.10000+101
 intlbfgs> interpolation using closest constraints
 checkrep> number of active repulsions and total=       8       8
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.3983661784         2.267691205    
 intlbfgs> largest atomic distance between images is     0.2191642601     for atom      9 and images      1     2 total images=     1
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.3974846179        0.5551115123E-14
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:      8   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.2798568501E-01         8     3
 intlbfgs> Choosing new active atom        7 new constraints=       3 maximum constraints available and possible=       3       3 shortest constraint=        1.09184
 intlbfgs> New active atom      7 closest average distances in endpoints:
     3     8     1     2     6    15    14     9
 intlbfgs> sorted average distances:
   1.092       1.769       1.783       2.576       4.707       4.977       5.238       5.292    
 intlbfgs> New active atom is number      7 total=     9 steps=     9
 intlbfgs> New active atom      7 is constrained to      3 other active atoms:
     3     8     1
 intlbfgs> sorted distances:
   1.092       1.769       1.783    
 intlbfgs> Turning on constraint     16 for atoms      3     7
 intlbfgs> Turning on constraint     27 for atoms      7     8
 intlbfgs> Turning on constraint      3 for atoms      1     7
 intlbfgs> initial guess from closest three constrained active atoms,      3     8     1
 checkrep> number of active repulsions and total=      13      13
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.4338032601        0.2168404179    
 intlbfgs> energies for constrained, preserved, closest, and linear schemes=     0.0000        0.10000+101    0.10000+101    0.10000+101
 intlbfgs> interpolation using closest constraints
 checkrep> number of active repulsions and total=      13      13
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.4338032601        0.2168404179    
 intlbfgs> largest atomic distance between images is     0.2191642601     for atom      9 and images      1     2 total images=     1
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.4337731003         0.000000000    
 intlbfgs> Highest image        2 energy      0.000000000     is      0.000000000     sigma from the mean
 intlbfgs> steps:      9   -0.1000000000+201   -0.1000000000+201   -0.1000000000+201     0.000000000        0.5201038658E-02         9     3
 intlbfgs> Mean deviation      0.000000000     Decreasing QCI force constant to      2.940888148    
 intlbfgs> Choosing new active atom        5 new constraints=       3 maximum constraints available and possible=       3       3 shortest constraint=        1.54049
 intlbfgs> New active atom      5 closest average distances in endpoints:
     2     3     8     6    14     7    15     1     9
 intlbfgs> sorted average distances:
   1.540       2.507       2.540       2.737       2.773       2.963       3.133       3.413       3.614    
 intlbfgs> New active atom is number      5 total=    10 steps=    10
 intlbfgs> New active atom      5 is constrained to      3 other active atoms:
     2     3     1
 intlbfgs> sorted distances:
   1.540       2.507       3.413    
 intlbfgs> Turning on constraint      7 for atoms      2     5
 intlbfgs> Turning on constraint     14 for atoms      3     5
 intlbfgs> Turning on constraint      2 for atoms      1     5
 intlbfgs> initial guess from closest three constrained active atoms,      2     3     1
 checkrep> number of active repulsions and total=      19      19
 congrad> Highest repulsion  for image      2 ind     17 atoms      9     5 value=    0.34702E-04 d,cutoff=     3.5848         3.5971     max grad=    0.42684E-02
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.4958940546         12.11644681    
 intlbfgs> energies for constrained, preserved, closest, and linear schemes=    0.34702E-04    0.10000+101    0.10000+101    0.10000+101
 intlbfgs> interpolation using closest constraints
 checkrep> number of active repulsions and total=      19      19
 congrad> Highest repulsion  for image      2 ind     17 atoms      9     5 value=    0.34702E-04 d,cutoff=     3.5848         3.5971     max grad=    0.42684E-02
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.4958940546         12.11644681    
 intlbfgs> largest atomic distance between images is     0.2192105752     for atom      9 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     17 atoms      9     5 value=    0.39160E-05 d,cutoff=     3.5929         3.5971     max grad=    0.14281E-02
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.4742373305        0.1318743872    
 intlbfgs> Highest image        2 energy     0.3915985394E-05 is      0.000000000     sigma from the mean
 intlbfgs> steps:     10   -0.1000000000+201    0.3915985394E-05   -0.1000000000+201    0.1428146057E-02    0.1553895722            10     3
 intlbfgs> Choosing new active atom       10 new constraints=       1 maximum constraints available and possible=       2       1 shortest constraint=        1.52494
 intlbfgs> New active atom     10 closest average distances in endpoints:
     2     5     3     8     6    14     1     9     7    15
 intlbfgs> sorted average distances:
   1.525       1.724       2.460       2.576       2.833       2.855       2.863       3.324       3.370       3.654    
 intlbfgs> New active atom is number     10 total=    11 steps=    11
 intlbfgs> New active atom     10 is constrained to      1 other active atoms:
     2
 intlbfgs> sorted distances:
   1.525    
 intlbfgs> Turning on constraint     11 for atoms      2    10
 intlbfgs> choosing positions      1     2     3 in closest list
 checkrep> number of active repulsions and total=      28      28
 congrad> Highest repulsion  for image      2 ind     17 atoms      9     5 value=    0.39160E-05 d,cutoff=     3.5929         3.5971     max grad=    0.14281E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.6140768975        0.8214068613E-01
 intlbfgs> energies for constrained, preserved, closest, and linear schemes=    0.10000+101    0.10000+101    0.39160E-05    0.10000+101
 intlbfgs> lowest energy from interpolation using closest atoms
 checkrep> number of active repulsions and total=      28      28
 congrad> Highest repulsion  for image      2 ind     17 atoms      9     5 value=    0.39160E-05 d,cutoff=     3.5929         3.5971     max grad=    0.14281E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.6140768975        0.8214068613E-01
 intlbfgs> largest atomic distance between images is     0.3868951515     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.17024E-03 d,cutoff=     3.3256         3.3508     max grad=    0.96913E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.6120336686        0.1685363402E-02
 intlbfgs> Highest image        2 energy     0.1768140348E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     11   -0.1000000000+201    0.1702426872E-03   -0.1000000000+201    0.9691337438E-02    0.5004387407E-01        11     3
 intlbfgs> Choosing new active atom       12 new constraints=       2 maximum constraints available and possible=       2       2 shortest constraint=        2.80132
 intlbfgs> New active atom     12 closest average distances in endpoints:
     1     7     2     3    10     8     5     6     9    15
 intlbfgs> sorted average distances:
   2.604       2.726       2.748       2.801       3.831       3.873       4.090       4.154       4.257       4.438    
 intlbfgs> New active atom is number     12 total=    12 steps=    12
 intlbfgs> New active atom     12 is constrained to      2 other active atoms:
     3    14
 intlbfgs> sorted distances:
   2.801       5.002    
 intlbfgs> Turning on constraint     18 for atoms      3    12
 intlbfgs> Turning on constraint     35 for atoms     12    14
 intlbfgs> choosing positions      1     2     3 in closest list
 checkrep> number of active repulsions and total=      37      37
 congrad> Highest repulsion  for image      2 ind     30 atoms      2    12 value=    0.32505E-03 d,cutoff=     2.7016         2.7298     max grad=    0.25473E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.6703432467        0.1796157523    
 intlbfgs> energies for constrained, preserved, closest, and linear schemes=    0.10000+101    0.10000+101    0.53112E-03    0.10000+101
 intlbfgs> lowest energy from interpolation using closest atoms
 checkrep> number of active repulsions and total=      37      37
 congrad> Highest repulsion  for image      2 ind     30 atoms      2    12 value=    0.32505E-03 d,cutoff=     2.7016         2.7298     max grad=    0.25473E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.6703432467        0.1796157523    
 intlbfgs> largest atomic distance between images is     0.3871446879     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11735E-03 d,cutoff=     3.3299         3.3508     max grad=    0.80902E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.6696599587        0.4317821425E-02
 intlbfgs> Highest image        2 energy     0.1235612069E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     12   -0.1000000000+201    0.1173456173E-03   -0.1000000000+201    0.8090199323E-02    0.3354688902E-01        12     3
 intlbfgs> Choosing new active atom        4 new constraints=       1 maximum constraints available and possible=       2       1 shortest constraint=        1.01422
 intlbfgs> New active atom      4 closest average distances in endpoints:
    12     2     1     3     7     6     9    10    15     5
 intlbfgs> sorted average distances:
   1.014       2.228       2.909       2.983       3.142       3.264       3.270       3.335       3.619       3.703    
 intlbfgs> New active atom is number      4 total=    13 steps=    13
 intlbfgs> New active atom      4 is constrained to      1 other active atoms:
    12
 intlbfgs> sorted distances:
   1.014    
 intlbfgs> Turning on constraint     21 for atoms      4    12
 intlbfgs> choosing positions      1     2     3 in closest list
 checkrep> number of active repulsions and total=      48      48
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11735E-03 d,cutoff=     3.3299         3.3508     max grad=    0.80902E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.6788721693        0.2519183582    
 intlbfgs> energies for constrained, preserved, closest, and linear schemes=    0.10000+101    0.10000+101    0.12510E-03    0.10000+101
 intlbfgs> lowest energy from interpolation using closest atoms
 checkrep> number of active repulsions and total=      48      48
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11735E-03 d,cutoff=     3.3299         3.3508     max grad=    0.80902E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.6788721693        0.2519183582    
 intlbfgs> largest atomic distance between images is     0.3871327067     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.12092E-03 d,cutoff=     3.3296         3.3508     max grad=    0.81982E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.6785640321        0.3857429256E-01
 intlbfgs> Highest image        2 energy     0.1292137906E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     13   -0.1000000000+201    0.1209206461E-03   -0.1000000000+201    0.8198238913E-02    0.1812823228E-01        13     3
 intlbfgs> Choosing new active atom       11 new constraints=       3 maximum constraints available and possible=       3       3 shortest constraint=        1.01381
 intlbfgs> New active atom     11 closest average distances in endpoints:
     4    12     2     9     6    15     3     7     1    10
 intlbfgs> sorted average distances:
   1.014       1.627       2.832       3.148       3.251       3.372       3.843       3.843       3.868       4.064    
 intlbfgs> New active atom is number     11 total=    14 steps=    14
 intlbfgs> New active atom     11 is constrained to      3 other active atoms:
     4    12     7
 intlbfgs> sorted distances:
   1.014       1.627       3.843    
 intlbfgs> Turning on constraint     20 for atoms      4    11
 intlbfgs> Turning on constraint     32 for atoms     11    12
 intlbfgs> Turning on constraint     28 for atoms      7    11
 intlbfgs> initial guess from closest three constrained active atoms,      4    12     7
 checkrep> number of active repulsions and total=      58      58
 congrad> Highest repulsion  for image      2 ind     50 atoms      2    11 value=    0.33062E-02 d,cutoff=     2.7214         2.8128     max grad=    0.13567    
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7088668877         1.857869754    
 intlbfgs> energies for constrained, preserved, closest, and linear schemes=    0.55244E-02    0.10000+101    0.10000+101    0.10000+101
 intlbfgs> interpolation using closest constraints
 checkrep> number of active repulsions and total=      58      58
 congrad> Highest repulsion  for image      2 ind     50 atoms      2    11 value=    0.33062E-02 d,cutoff=     2.7214         2.8128     max grad=    0.13567    
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7088668877         1.857869754    
 intlbfgs> largest atomic distance between images is     0.3871213714     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.12301E-03 d,cutoff=     3.3294         3.3508     max grad=    0.82138E-02
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.6861981574        0.1370953941E-01
 intlbfgs> Highest image        2 energy     0.1261581770E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     14   -0.1000000000+201    0.1230129141E-03   -0.1000000000+201    0.8213790987E-02    0.1936302963            14     3
 intlbfgs> Mean deviation     0.1370953941E-01 Decreasing QCI force constant to      2.911770444    
 intlbfgs> Choosing new active atom       13 new constraints=       3 maximum constraints available and possible=       3       3 shortest constraint=        1.01448
 intlbfgs> New active atom     13 closest average distances in endpoints:
     4    12    11     2     1     9     3    10     6     7
 intlbfgs> sorted average distances:
   1.014       1.621       1.625       2.749       3.104       3.381       3.446       3.499       3.608       3.806    
 intlbfgs> New active atom is number     13 total=    15 steps=    15
 intlbfgs> New active atom     13 is constrained to      3 other active atoms:
     4    12    11
 intlbfgs> sorted distances:
   1.014       1.621       1.625    
 intlbfgs> Turning on constraint     22 for atoms      4    13
 intlbfgs> Turning on constraint     34 for atoms     12    13
 intlbfgs> Turning on constraint     33 for atoms     11    13
 intlbfgs> initial guess from closest three constrained active atoms,      4    12    11
 checkrep> number of active repulsions and total=      69      69
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.12301E-03 d,cutoff=     3.3294         3.3508     max grad=    0.82138E-02
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.7141314429        0.3232869304    
 intlbfgs> energies for constrained, preserved, closest, and linear schemes=    0.12616E-03    0.10000+101    0.10000+101    0.10000+101
 intlbfgs> interpolation using closest constraints
 checkrep> number of active repulsions and total=      69      69
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.12301E-03 d,cutoff=     3.3294         3.3508     max grad=    0.82138E-02
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.7141314429        0.3232869304    
 intlbfgs> largest atomic distance between images is     0.3871316001     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11983E-03 d,cutoff=     3.3297         3.3508     max grad=    0.81723E-02
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.7133331688        0.4281793064E-01
 intlbfgs> Highest image        2 energy     0.1280157258E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     15   -0.1000000000+201    0.1198261927E-03   -0.1000000000+201    0.8172326652E-02    0.2907991932E-01        15     3
 intlbfgs> switch on true potential at step     15 fraction=    0.000000 images=     1 time=    0.2685000000E-02
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> Allowing   1000 further optimization steps
 intlbfgs> largest atomic distance between images is     0.3870398496     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     50 atoms      2    11 value=    0.34989E-02 d,cutoff=     2.7189         2.8128     max grad=    0.17727    
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7227055616         1.545564065    
 intlbfgs> Highest QCI image energy=    0.8561376959E-02 images=       1
 intlbfgs> Highest image        2 energy     0.8561376959E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     16   -0.1000000000+201    0.3498875119E-02   -0.1000000000+201    0.1772725264        0.1219259071            15     3
 intlbfgs> largest atomic distance between images is     0.3870056600     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     30 atoms      2    12 value=    0.12028E-02 d,cutoff=     2.6758         2.7298     max grad=    0.54151E-01
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.7170586371        0.3817106193    
 intlbfgs> Highest QCI image energy=    0.1573742988E-02 images=       1
 intlbfgs> Highest image        2 energy     0.1573742988E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     17   -0.1000000000+201    0.1202767782E-02   -0.1000000000+201    0.5415094173E-01    0.1311630261            15     3
 intlbfgs> largest atomic distance between images is     0.3912925548     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     30 atoms      2    12 value=    0.71249E-03 d,cutoff=     2.6881         2.7298     max grad=    0.57321E-01
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7344489499        0.4953331781    
 intlbfgs> Highest QCI image energy=    0.2512136451E-02 images=       1
 intlbfgs> Highest image        2 energy     0.2512136451E-02 is      0.000000000     sigma from the mean
 intlbfgs> steps:     18   -0.1000000000+201    0.7124909317E-03   -0.1000000000+201    0.5732125505E-01    0.6952028046            15     3
 intlbfgs> largest atomic distance between images is     0.3879387832     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.90198E-04 d,cutoff=     3.3325         3.3508     max grad=    0.70484E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7138703038        0.1093306005    
 intlbfgs> Highest QCI image energy=    0.9481310188E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9481310188E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:     19   -0.1000000000+201    0.9019772693E-04   -0.1000000000+201    0.7048433728E-02    0.1850832802            15     3
 intlbfgs> Mean deviation     0.1093306005     Decreasing QCI force constant to      2.882941033    
 intlbfgs> largest atomic distance between images is     0.3890540874     for atom     10 and images      2     3 total images=     1
 congrad> Highest repulsion  for image      2 ind     30 atoms      2    12 value=    0.96201E-02 d,cutoff=     2.5809         2.7298     max grad=    0.17763    
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7355976573        0.5998583199    
 intlbfgs> Highest QCI image energy=    0.1451829387E-01 images=       1
 intlbfgs> Highest image        2 energy     0.1451829387E-01 is      0.000000000     sigma from the mean
 intlbfgs> steps:     20   -0.1000000000+201    0.9620089403E-02   -0.1000000000+201    0.1776265074         2.768936315            15     3
 intlbfgs> largest atomic distance between images is     0.3871904677     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11842E-03 d,cutoff=     3.3298         3.3508     max grad=    0.80906E-02
 congrad> Highest spring  contribution for any image in image      2
 congrad> mean gap and mean deviation=    0.7133374630        0.3424264379E-03
 intlbfgs> Highest QCI image energy=    0.1237911728E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1237911728E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     21   -0.1000000000+201    0.1184201933E-03   -0.1000000000+201    0.8090552533E-02    0.1837916636            15     3
 intlbfgs> largest atomic distance between images is     0.3871393659     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11982E-03 d,cutoff=     3.3297         3.3508     max grad=    0.81578E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133136210        0.6900436745E-02
 intlbfgs> Highest QCI image energy=    0.1276029593E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1276029593E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     22   -0.1000000000+201    0.1198196224E-03   -0.1000000000+201    0.8157811584E-02    0.4307434470E-02        15     3
 intlbfgs> largest atomic distance between images is     0.3871330688     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.12080E-03 d,cutoff=     3.3296         3.3508     max grad=    0.81939E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133113578        0.8577747599E-02
 intlbfgs> Highest QCI image energy=    0.1307263456E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1307263456E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     23   -0.1000000000+201    0.1208019849E-03   -0.1000000000+201    0.8193901764E-02    0.1596538546E-02        15     3
 intlbfgs> largest atomic distance between images is     0.3871333306     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.12072E-03 d,cutoff=     3.3296         3.3508     max grad=    0.81919E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133114619        0.7924464484E-02
 intlbfgs> Highest QCI image energy=    0.1300362348E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1300362348E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     24   -0.1000000000+201    0.1207238877E-03   -0.1000000000+201    0.8191949306E-02    0.2762586961E-03        15     3
 intlbfgs> Mean deviation     0.7924464484E-02 Decreasing QCI force constant to      2.854397063    
 intlbfgs> largest atomic distance between images is     0.3871333897     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.12073E-03 d,cutoff=     3.3296         3.3508     max grad=    0.81920E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133114560        0.7888600467E-02
 intlbfgs> Highest QCI image energy=    0.1300596714E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1300596714E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     25   -0.1000000000+201    0.1207262015E-03   -0.1000000000+201    0.8191989695E-02    0.1351414462E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3871339135     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.12064E-03 d,cutoff=     3.3296         3.3508     max grad=    0.81890E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133114760        0.7871153488E-02
 intlbfgs> Highest QCI image energy=    0.1299778686E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1299778686E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     26   -0.1000000000+201    0.1206391514E-03   -0.1000000000+201    0.8189027192E-02    0.1030192168E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3871344957     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.12053E-03 d,cutoff=     3.3296         3.3508     max grad=    0.81855E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133115042        0.7877144850E-02
 intlbfgs> Highest QCI image energy=    0.1298622849E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1298622849E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     27   -0.1000000000+201    0.1205340457E-03   -0.1000000000+201    0.8185469264E-02    0.7150691852E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3871354621     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.12035E-03 d,cutoff=     3.3296         3.3508     max grad=    0.81793E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133115544        0.7926552323E-02
 intlbfgs> Highest QCI image energy=    0.1296567136E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1296567136E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     28   -0.1000000000+201    0.1203506354E-03   -0.1000000000+201    0.8179270218E-02    0.1335718883E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3871354843     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.12034E-03 d,cutoff=     3.3296         3.3508     max grad=    0.81791E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133115564        0.7938368782E-02
 intlbfgs> Highest QCI image energy=    0.1296486898E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1296486898E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     29   -0.1000000000+201    0.1203441990E-03   -0.1000000000+201    0.8179053961E-02    0.2047780912E-05        15     3
 intlbfgs> Mean deviation     0.7938368782E-02 Decreasing QCI force constant to      2.826135706    
 intlbfgs> largest atomic distance between images is     0.3871354698     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.12035E-03 d,cutoff=     3.3296         3.3508     max grad=    0.81791E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133115559        0.7940090651E-02
 intlbfgs> Highest QCI image energy=    0.1296508029E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1296508029E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     30   -0.1000000000+201    0.1203463849E-03   -0.1000000000+201    0.8179128375E-02    0.3915129706E-06        15     3
 intlbfgs> largest atomic distance between images is     0.3871354619     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.12035E-03 d,cutoff=     3.3296         3.3508     max grad=    0.81791E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133115565        0.7950729845E-02
 intlbfgs> Highest QCI image energy=    0.1296482825E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1296482825E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     31   -0.1000000000+201    0.1203454252E-03   -0.1000000000+201    0.8179097982E-02    0.1948803534E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3871355479     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.12033E-03 d,cutoff=     3.3296         3.3508     max grad=    0.81786E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133115611        0.7949510936E-02
 intlbfgs> Highest QCI image energy=    0.1296296978E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1296296978E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     32   -0.1000000000+201    0.1203300258E-03   -0.1000000000+201    0.8178577433E-02    0.1525108955E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3871369896     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.12007E-03 d,cutoff=     3.3297         3.3508     max grad=    0.81697E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133116322        0.7971488797E-02
 intlbfgs> Highest QCI image energy=    0.1293412885E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1293412885E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     33   -0.1000000000+201    0.1200687070E-03   -0.1000000000+201    0.8169725771E-02    0.1782045947E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3871374684     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11998E-03 d,cutoff=     3.3297         3.3508     max grad=    0.81667E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133116543        0.7995611808E-02
 intlbfgs> Highest QCI image energy=    0.1292520256E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1292520256E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     34   -0.1000000000+201    0.1199803817E-03   -0.1000000000+201    0.8166722581E-02    0.6398606488E-05        15     3
 intlbfgs> Mean deviation     0.7995611808E-02 Decreasing QCI force constant to      2.798154164    
 intlbfgs> largest atomic distance between images is     0.3871375476     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11996E-03 d,cutoff=     3.3297         3.3508     max grad=    0.81662E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133116573        0.8006783555E-02
 intlbfgs> Highest QCI image energy=    0.1292395870E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1292395870E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     35   -0.1000000000+201    0.1199647716E-03   -0.1000000000+201    0.8166189174E-02    0.2770592692E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3871389152     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11968E-03 d,cutoff=     3.3297         3.3508     max grad=    0.81562E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133117034        0.8349925639E-02
 intlbfgs> Highest QCI image energy=    0.1290819109E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1290819109E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     36   -0.1000000000+201    0.1196755949E-03   -0.1000000000+201    0.8156247460E-02    0.9041727274E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3871375524     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11996E-03 d,cutoff=     3.3297         3.3508     max grad=    0.81661E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133116568        0.8015024886E-02
 intlbfgs> Highest QCI image energy=    0.1292418396E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1292418396E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     37   -0.1000000000+201    0.1199629337E-03   -0.1000000000+201    0.8166122355E-02    0.8787193667E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3871375846     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11996E-03 d,cutoff=     3.3297         3.3508     max grad=    0.81659E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133116584        0.8015793514E-02
 intlbfgs> Highest QCI image energy=    0.1292350871E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1292350871E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     38   -0.1000000000+201    0.1199569301E-03   -0.1000000000+201    0.8165919637E-02    0.4314253766E-06        15     3
 intlbfgs> largest atomic distance between images is     0.3871396113     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11959E-03 d,cutoff=     3.3297         3.3508     max grad=    0.81533E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133117595        0.8074625607E-02
 intlbfgs> Highest QCI image energy=    0.1288297166E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1288297166E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     39   -0.1000000000+201    0.1195855592E-03   -0.1000000000+201    0.8153311508E-02    0.2438826239E-04        15     3
 intlbfgs> Mean deviation     0.8074625607E-02 Decreasing QCI force constant to      2.770449667    
 intlbfgs> largest atomic distance between images is     0.3871396375     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11958E-03 d,cutoff=     3.3297         3.3508     max grad=    0.81532E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133117603        0.8074620288E-02
 intlbfgs> Highest QCI image energy=    0.1288263251E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1288263251E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     40   -0.1000000000+201    0.1195815190E-03   -0.1000000000+201    0.8153171540E-02    0.5713219121E-06        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3871395794     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11959E-03 d,cutoff=     3.3297         3.3508     max grad=    0.81534E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133117608        0.8077468564E-02
 intlbfgs> Highest QCI image energy=    0.1288244410E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1288244410E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     41   -0.1000000000+201    0.1195868675E-03   -0.1000000000+201    0.8153372925E-02    0.4199160800E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3871396601     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11958E-03 d,cutoff=     3.3297         3.3508     max grad=    0.81531E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133117615        0.8071949291E-02
 intlbfgs> Highest QCI image energy=    0.1288215991E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1288215991E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     42   -0.1000000000+201    0.1195780941E-03   -0.1000000000+201    0.8153055386E-02    0.3631834367E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3871397323     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11957E-03 d,cutoff=     3.3297         3.3508     max grad=    0.81527E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133117634        0.8069789149E-02
 intlbfgs> Highest QCI image energy=    0.1288138891E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1288138891E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     43   -0.1000000000+201    0.1195679764E-03   -0.1000000000+201    0.8152702311E-02    0.1816380896E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3871400462     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11952E-03 d,cutoff=     3.3297         3.3508     max grad=    0.81510E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133117746        0.8068219872E-02
 intlbfgs> Highest QCI image energy=    0.1287695015E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1287695015E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     44   -0.1000000000+201    0.1195190262E-03   -0.1000000000+201    0.8151010820E-02    0.5317565249E-05        15     3
 intlbfgs> Mean deviation     0.8068219872E-02 Decreasing QCI force constant to      2.743019473    
 intlbfgs> largest atomic distance between images is     0.3871417388     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11919E-03 d,cutoff=     3.3297         3.3508     max grad=    0.81400E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133118652        0.8141351303E-02
 intlbfgs> Highest QCI image energy=    0.1284097098E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1284097098E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     45   -0.1000000000+201    0.1191946700E-03   -0.1000000000+201    0.8140037074E-02    0.2226882653E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3871472815     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11825E-03 d,cutoff=     3.3298         3.3508     max grad=    0.81078E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133120983        0.8207044608E-02
 intlbfgs> Highest QCI image energy=    0.1275107998E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1275107998E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     46   -0.1000000000+201    0.1182485969E-03   -0.1000000000+201    0.8107750910E-02    0.8320293010E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3871463845     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11820E-03 d,cutoff=     3.3298         3.3508     max grad=    0.81069E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133121562        0.8454559706E-02
 intlbfgs> Highest QCI image energy=    0.1272791026E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1272791026E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     47   -0.1000000000+201    0.1182027309E-03   -0.1000000000+201    0.8106947511E-02    0.1014391594E-03        15     3
 intlbfgs> largest atomic distance between images is     0.3871399920     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11959E-03 d,cutoff=     3.3297         3.3508     max grad=    0.81528E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133117636        0.8037753149E-02
 intlbfgs> Highest QCI image energy=    0.1288134096E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1288134096E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     48   -0.1000000000+201    0.1195888014E-03   -0.1000000000+201    0.8152829363E-02    0.9808443075E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3871441284     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11877E-03 d,cutoff=     3.3298         3.3508     max grad=    0.81256E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133119791        0.8191277773E-02
 intlbfgs> Highest QCI image energy=    0.1279618525E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1279618525E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     49   -0.1000000000+201    0.1187737755E-03   -0.1000000000+201    0.8125645129E-02    0.5322209697E-04        15     3
 intlbfgs> Mean deviation     0.8191277773E-02 Decreasing QCI force constant to      2.715860864    
 intlbfgs> largest atomic distance between images is     0.3871438656     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11881E-03 d,cutoff=     3.3298         3.3508     max grad=    0.81269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133119710        0.8210192438E-02
 intlbfgs> Highest QCI image energy=    0.1279932499E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1279932499E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     50   -0.1000000000+201    0.1188087756E-03   -0.1000000000+201    0.8126863978E-02    0.6679173242E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3871439631     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11874E-03 d,cutoff=     3.3298         3.3508     max grad=    0.81247E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133119945        0.8295493299E-02
 intlbfgs> Highest QCI image energy=    0.1279020388E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1279020388E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     51   -0.1000000000+201    0.1187411995E-03   -0.1000000000+201    0.8124742648E-02    0.1836558218E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3871442747     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11871E-03 d,cutoff=     3.3298         3.3508     max grad=    0.81236E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133119999        0.8257432344E-02
 intlbfgs> Highest QCI image energy=    0.1278802201E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1278802201E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     52   -0.1000000000+201    0.1187097316E-03   -0.1000000000+201    0.8123603317E-02    0.1133438605E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3871450209     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11860E-03 d,cutoff=     3.3298         3.3508     max grad=    0.81196E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133120291        0.8245579953E-02
 intlbfgs> Highest QCI image energy=    0.1277662953E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1277662953E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     53   -0.1000000000+201    0.1185964744E-03   -0.1000000000+201    0.8119648052E-02    0.1045681445E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3871457919     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11846E-03 d,cutoff=     3.3298         3.3508     max grad=    0.81151E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133120656        0.8260783112E-02
 intlbfgs> Highest QCI image energy=    0.1276244903E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1276244903E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     54   -0.1000000000+201    0.1184636871E-03   -0.1000000000+201    0.8115074186E-02    0.8678914795E-05        15     3
 intlbfgs> Mean deviation     0.8260783112E-02 Decreasing QCI force constant to      2.688971153    
 intlbfgs> largest atomic distance between images is     0.3871460038     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11842E-03 d,cutoff=     3.3298         3.3508     max grad=    0.81136E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133120787        0.8279190164E-02
 intlbfgs> Highest QCI image energy=    0.1275739400E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1275739400E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     55   -0.1000000000+201    0.1184195042E-03   -0.1000000000+201    0.8113577053E-02    0.4228721879E-05        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3871463288     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11837E-03 d,cutoff=     3.3298         3.3508     max grad=    0.81118E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133120921        0.8276295166E-02
 intlbfgs> Highest QCI image energy=    0.1275219533E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1275219533E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     56   -0.1000000000+201    0.1183686338E-03   -0.1000000000+201    0.8111807442E-02    0.4205460104E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3871484945     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11797E-03 d,cutoff=     3.3298         3.3508     max grad=    0.80981E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133122063        0.8364693436E-02
 intlbfgs> Highest QCI image energy=    0.1270819926E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1270819926E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     57   -0.1000000000+201    0.1179694949E-03   -0.1000000000+201    0.8098131370E-02    0.2770351847E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3871481740     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11803E-03 d,cutoff=     3.3298         3.3508     max grad=    0.81001E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133121886        0.8347422593E-02
 intlbfgs> Highest QCI image energy=    0.1271497848E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1271497848E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     58   -0.1000000000+201    0.1180250832E-03   -0.1000000000+201    0.8100102718E-02    0.7370614130E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3871481554     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11803E-03 d,cutoff=     3.3298         3.3508     max grad=    0.81002E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133121879        0.8347787402E-02
 intlbfgs> Highest QCI image energy=    0.1271527937E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1271527937E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     59   -0.1000000000+201    0.1180289740E-03   -0.1000000000+201    0.8100223150E-02    0.5788108253E-06        15     3
 intlbfgs> Mean deviation     0.8347787402E-02 Decreasing QCI force constant to      2.662347676    
 intlbfgs> largest atomic distance between images is     0.3871481572     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11803E-03 d,cutoff=     3.3298         3.3508     max grad=    0.81002E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133121880        0.8347978971E-02
 intlbfgs> Highest QCI image energy=    0.1271522972E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1271522972E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     60   -0.1000000000+201    0.1180284369E-03   -0.1000000000+201    0.8100206361E-02    0.3948814982E-07        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3871481593     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11803E-03 d,cutoff=     3.3298         3.3508     max grad=    0.81002E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133121881        0.8348138168E-02
 intlbfgs> Highest QCI image energy=    0.1271518003E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1271518003E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     61   -0.1000000000+201    0.1180279698E-03   -0.1000000000+201    0.8100190831E-02    0.3299027843E-07        15     3
 intlbfgs> largest atomic distance between images is     0.3871501861     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11764E-03 d,cutoff=     3.3299         3.3508     max grad=    0.80869E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133122972        0.8436779809E-02
 intlbfgs> Highest QCI image energy=    0.1267351339E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1267351339E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     62   -0.1000000000+201    0.1176355098E-03   -0.1000000000+201    0.8086906224E-02    0.2525631144E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3871503564     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11764E-03 d,cutoff=     3.3299         3.3508     max grad=    0.80868E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133122993        0.8414323913E-02
 intlbfgs> Highest QCI image energy=    0.1267272760E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1267272760E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     63   -0.1000000000+201    0.1176381772E-03   -0.1000000000+201    0.8086761563E-02    0.3245366367E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3871503246     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11764E-03 d,cutoff=     3.3299         3.3508     max grad=    0.80867E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133122990        0.8418340249E-02
 intlbfgs> Highest QCI image energy=    0.1267284189E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1267284189E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     64   -0.1000000000+201    0.1176352460E-03   -0.1000000000+201    0.8086739589E-02    0.1278105479E-05        15     3
 intlbfgs> Mean deviation     0.8418340249E-02 Decreasing QCI force constant to      2.635987798    
 intlbfgs> largest atomic distance between images is     0.3871503248     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11764E-03 d,cutoff=     3.3299         3.3508     max grad=    0.80867E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133122989        0.8417696240E-02
 intlbfgs> Highest QCI image energy=    0.1267286079E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1267286079E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     65   -0.1000000000+201    0.1176353387E-03   -0.1000000000+201    0.8086744811E-02    0.1078015823E-06        15     3
 intlbfgs> largest atomic distance between images is     0.3871504215     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11763E-03 d,cutoff=     3.3299         3.3508     max grad=    0.80867E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133122992        0.8370602059E-02
 intlbfgs> Highest QCI image energy=    0.1267279311E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1267279311E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     66   -0.1000000000+201    0.1176281370E-03   -0.1000000000+201    0.8086660356E-02    0.8319828136E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3871503278     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11763E-03 d,cutoff=     3.3299         3.3508     max grad=    0.80867E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133122990        0.8416917636E-02
 intlbfgs> Highest QCI image energy=    0.1267283174E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1267283174E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     67   -0.1000000000+201    0.1176349237E-03   -0.1000000000+201    0.8086733929E-02    0.8157334968E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3871503286     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11763E-03 d,cutoff=     3.3299         3.3508     max grad=    0.80867E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133122991        0.8417300195E-02
 intlbfgs> Highest QCI image energy=    0.1267280412E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1267280412E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     68   -0.1000000000+201    0.1176347095E-03   -0.1000000000+201    0.8086725527E-02    0.6419728209E-07        15     3
 intlbfgs> largest atomic distance between images is     0.3871505912     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11758E-03 d,cutoff=     3.3299         3.3508     max grad=    0.80847E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133123163        0.8465661733E-02
 intlbfgs> Highest QCI image energy=    0.1266628677E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1266628677E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     69   -0.1000000000+201    0.1175790937E-03   -0.1000000000+201    0.8084695942E-02    0.7980192050E-05        15     3
 intlbfgs> Mean deviation     0.8465661733E-02 Decreasing QCI force constant to      2.609888909    
 intlbfgs> largest atomic distance between images is     0.3871526525     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11721E-03 d,cutoff=     3.3299         3.3508     max grad=    0.80723E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133124193        0.8484922107E-02
 intlbfgs> Highest QCI image energy=    0.1262735922E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1262735922E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     70   -0.1000000000+201    0.1172125661E-03   -0.1000000000+201    0.8072292193E-02    0.2490584697E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3926107357     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     26 atoms      9    10 value=    0.34922E-05 d,cutoff=     3.2863         3.2899     max grad=    0.16897E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7152752780        0.5339547926E-01
 intlbfgs> Highest QCI image energy=    0.3492180883E-05 images=       1
 intlbfgs> Highest image        2 energy     0.3492180883E-05 is      0.000000000     sigma from the mean
 intlbfgs> steps:     71   -0.1000000000+201    0.3492180883E-05   -0.1000000000+201    0.1689663042E-02    0.5005321384E-01        15     3
 intlbfgs> largest atomic distance between images is     0.3871548244     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11683E-03 d,cutoff=     3.3299         3.3508     max grad=    0.80592E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133125288        0.8514105071E-02
 intlbfgs> Highest QCI image energy=    0.1258642418E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1258642418E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     72   -0.1000000000+201    0.1168266273E-03   -0.1000000000+201    0.8059188414E-02    0.5002736393E-01        15     3
 intlbfgs> largest atomic distance between images is     0.3871545761     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11687E-03 d,cutoff=     3.3299         3.3508     max grad=    0.80607E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133125159        0.8512484632E-02
 intlbfgs> Highest QCI image energy=    0.1259122553E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1259122553E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     73   -0.1000000000+201    0.1168736590E-03   -0.1000000000+201    0.8060733988E-02    0.3269440982E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3871545395     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11688E-03 d,cutoff=     3.3299         3.3508     max grad=    0.80609E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133125144        0.8516150528E-02
 intlbfgs> Highest QCI image energy=    0.1259177689E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1259177689E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     74   -0.1000000000+201    0.1168794553E-03   -0.1000000000+201    0.8060914885E-02    0.9253539482E-06        15     3
 intlbfgs> Mean deviation     0.8516150528E-02 Decreasing QCI force constant to      2.584048424    
 intlbfgs> largest atomic distance between images is     0.3871547176     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11684E-03 d,cutoff=     3.3299         3.3508     max grad=    0.80596E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133125259        0.8556472857E-02
 intlbfgs> Highest QCI image energy=    0.1258747088E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1258747088E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     75   -0.1000000000+201    0.1168439895E-03   -0.1000000000+201    0.8059553280E-02    0.6686499825E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3871559071     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11657E-03 d,cutoff=     3.3300         3.3508     max grad=    0.80473E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133126414        0.9253691020E-02
 intlbfgs> Highest QCI image energy=    0.1254828360E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1254828360E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     76   -0.1000000000+201    0.1165719539E-03   -0.1000000000+201    0.8047332147E-02    0.1208956339E-03        15     3
 intlbfgs> largest atomic distance between images is     0.3871546649     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11684E-03 d,cutoff=     3.3299         3.3508     max grad=    0.80595E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133125262        0.8593865550E-02
 intlbfgs> Highest QCI image energy=    0.1258735698E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1258735698E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     77   -0.1000000000+201    0.1168449527E-03   -0.1000000000+201    0.8059499743E-02    0.1148066109E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3871547512     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11683E-03 d,cutoff=     3.3299         3.3508     max grad=    0.80589E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133125310        0.8594948892E-02
 intlbfgs> Highest QCI image energy=    0.1258557070E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1258557070E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     78   -0.1000000000+201    0.1168270139E-03   -0.1000000000+201    0.8058921134E-02    0.1248784453E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3871568878     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11645E-03 d,cutoff=     3.3300         3.3508     max grad=    0.80460E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133126404        0.8625881507E-02
 intlbfgs> Highest QCI image energy=    0.1254504533E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1254504533E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     79   -0.1000000000+201    0.1164485968E-03   -0.1000000000+201    0.8046003156E-02    0.2538667658E-04        15     3
 intlbfgs> Mean deviation     0.8625881507E-02 Decreasing QCI force constant to      2.558463787    
 intlbfgs> largest atomic distance between images is     0.3871569216     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11644E-03 d,cutoff=     3.3300         3.3508     max grad=    0.80458E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133126418        0.8629182202E-02
 intlbfgs> Highest QCI image energy=    0.1254451575E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1254451575E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     80   -0.1000000000+201    0.1164445505E-03   -0.1000000000+201    0.8045827263E-02    0.7251143262E-06        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3871569296     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11644E-03 d,cutoff=     3.3300         3.3508     max grad=    0.80457E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133126430        0.8618968394E-02
 intlbfgs> Highest QCI image energy=    0.1254407487E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1254407487E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     81   -0.1000000000+201    0.1164374213E-03   -0.1000000000+201    0.8045706244E-02    0.2616431992E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3871571605     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11641E-03 d,cutoff=     3.3300         3.3508     max grad=    0.80447E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133126514        0.8614080876E-02
 intlbfgs> Highest QCI image energy=    0.1254098262E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1254098262E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     82   -0.1000000000+201    0.1164116448E-03   -0.1000000000+201    0.8044686062E-02    0.2329980900E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3871590967     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11610E-03 d,cutoff=     3.3300         3.3508     max grad=    0.80336E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133127452        0.8652401045E-02
 intlbfgs> Highest QCI image energy=    0.1250659121E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1250659121E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     83   -0.1000000000+201    0.1160995412E-03   -0.1000000000+201    0.8033594566E-02    0.2113794834E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3871592079     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11605E-03 d,cutoff=     3.3300         3.3508     max grad=    0.80321E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133127587        0.8687700467E-02
 intlbfgs> Highest QCI image energy=    0.1250162894E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1250162894E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     84   -0.1000000000+201    0.1160488910E-03   -0.1000000000+201    0.8032070669E-02    0.4528602605E-05        15     3
 intlbfgs> Mean deviation     0.8687700467E-02 Decreasing QCI force constant to      2.533132462    
 intlbfgs> largest atomic distance between images is     0.3871591502     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11604E-03 d,cutoff=     3.3300         3.3508     max grad=    0.80320E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133127595        0.8700539175E-02
 intlbfgs> Highest QCI image energy=    0.1250133210E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1250133210E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     85   -0.1000000000+201    0.1160438031E-03   -0.1000000000+201    0.8032012791E-02    0.1572511645E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3871460887     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11533E-03 d,cutoff=     3.3301         3.3508     max grad=    0.80307E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133128996        0.1118362676E-01
 intlbfgs> Highest QCI image energy=    0.1247648446E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1247648446E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     86   -0.1000000000+201    0.1153259658E-03   -0.1000000000+201    0.8030657545E-02    0.3093063944E-03        15     3
 intlbfgs> largest atomic distance between images is     0.3871590768     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11604E-03 d,cutoff=     3.3300         3.3508     max grad=    0.80321E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133127595        0.8712985193E-02
 intlbfgs> Highest QCI image energy=    0.1250135076E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1250135076E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     87   -0.1000000000+201    0.1160416922E-03   -0.1000000000+201    0.8032055366E-02    0.3077400107E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3871590856     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11604E-03 d,cutoff=     3.3300         3.3508     max grad=    0.80320E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133127599        0.8713135436E-02
 intlbfgs> Highest QCI image energy=    0.1250119468E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1250119468E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     88   -0.1000000000+201    0.1160402795E-03   -0.1000000000+201    0.8032005238E-02    0.9610587204E-07        15     3
 intlbfgs> largest atomic distance between images is     0.3871613979     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11564E-03 d,cutoff=     3.3300         3.3508     max grad=    0.80181E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133128790        0.8772542047E-02
 intlbfgs> Highest QCI image energy=    0.1245793598E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1245793598E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     89   -0.1000000000+201    0.1156411552E-03   -0.1000000000+201    0.8018100080E-02    0.2638607657E-04        15     3
 intlbfgs> Mean deviation     0.8772542047E-02 Decreasing QCI force constant to      2.508051943    
 intlbfgs> largest atomic distance between images is     0.3871613967     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11564E-03 d,cutoff=     3.3300         3.3508     max grad=    0.80181E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133128790        0.8772517474E-02
 intlbfgs> Highest QCI image energy=    0.1245793182E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1245793182E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     90   -0.1000000000+201    0.1156411788E-03   -0.1000000000+201    0.8018103787E-02    0.6985699907E-07        15     3
 intlbfgs> largest atomic distance between images is     0.3871601540     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11569E-03 d,cutoff=     3.3300         3.3508     max grad=    0.80225E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133128825        0.8744952220E-02
 intlbfgs> Highest QCI image energy=    0.1245796092E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1245796092E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     91   -0.1000000000+201    0.1156942070E-03   -0.1000000000+201    0.8022535721E-02    0.6269562308E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3871613953     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11564E-03 d,cutoff=     3.3300         3.3508     max grad=    0.80181E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133128790        0.8772485720E-02
 intlbfgs> Highest QCI image energy=    0.1245793530E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1245793530E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     92   -0.1000000000+201    0.1156412581E-03   -0.1000000000+201    0.8018109326E-02    0.6263151869E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3871613955     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11564E-03 d,cutoff=     3.3300         3.3508     max grad=    0.80181E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133128790        0.8772492995E-02
 intlbfgs> Highest QCI image energy=    0.1245793152E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1245793152E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     93   -0.1000000000+201    0.1156412226E-03   -0.1000000000+201    0.8018108079E-02    0.2511792730E-08        15     3
 intlbfgs> largest atomic distance between images is     0.3871635684     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11525E-03 d,cutoff=     3.3301         3.3508     max grad=    0.80044E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133129969        0.8845345038E-02
 intlbfgs> Highest QCI image energy=    0.1241548896E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1241548896E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     94   -0.1000000000+201    0.1152467088E-03   -0.1000000000+201    0.8004445970E-02    0.2595219999E-04        15     3
 intlbfgs> Mean deviation     0.8845345038E-02 Decreasing QCI force constant to      2.483219745    
 intlbfgs> largest atomic distance between images is     0.3871636539     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11524E-03 d,cutoff=     3.3301         3.3508     max grad=    0.80041E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133130001        0.8845081207E-02
 intlbfgs> Highest QCI image energy=    0.1241433953E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1241433953E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     95   -0.1000000000+201    0.1152367113E-03   -0.1000000000+201    0.8004113373E-02    0.1728492131E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3871637990     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11524E-03 d,cutoff=     3.3301         3.3508     max grad=    0.80044E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133130003        0.8830251384E-02
 intlbfgs> Highest QCI image energy=    0.1241434816E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1241434816E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     96   -0.1000000000+201    0.1152421719E-03   -0.1000000000+201    0.8004442406E-02    0.1150970504E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3871636955     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11524E-03 d,cutoff=     3.3301         3.3508     max grad=    0.80040E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133130002        0.8843830788E-02
 intlbfgs> Highest QCI image energy=    0.1241430534E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1241430534E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     97   -0.1000000000+201    0.1152359413E-03   -0.1000000000+201    0.8004049080E-02    0.1145254051E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3871636976     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11524E-03 d,cutoff=     3.3301         3.3508     max grad=    0.80040E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133130003        0.8843672979E-02
 intlbfgs> Highest QCI image energy=    0.1241428618E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1241428618E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     98   -0.1000000000+201    0.1152357633E-03   -0.1000000000+201    0.8004040553E-02    0.4784987535E-07        15     3
 intlbfgs> largest atomic distance between images is     0.3871640826     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11519E-03 d,cutoff=     3.3301         3.3508     max grad=    0.80021E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133130147        0.8825832654E-02
 intlbfgs> Highest QCI image energy=    0.1240913935E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1240913935E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:     99   -0.1000000000+201    0.1151874992E-03   -0.1000000000+201    0.8002095972E-02    0.7044139028E-05        15     3
 intlbfgs> Mean deviation     0.8825832654E-02 Decreasing QCI force constant to      2.458633411    
 intlbfgs> largest atomic distance between images is     0.3871659851     for atom     10 and images      1     2 total images=     1
 checkrep> number of active repulsions and total=      69      69
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11481E-03 d,cutoff=     3.3301         3.3508     max grad=    0.79894E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133131292        0.8923053555E-02
 intlbfgs> Highest QCI image energy=    0.1236839138E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1236839138E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    100   -0.1000000000+201    0.1148100936E-03   -0.1000000000+201    0.7989418383E-02    0.2584614949E-04        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.3967521955     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     26 atoms      9    10 value=    0.35555E-04 d,cutoff=     3.2786         3.2899     max grad=    0.54048E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7180461346        0.2985099836    
 intlbfgs> Highest QCI image energy=    0.3555470411E-04 images=       1
 intlbfgs> Highest image        2 energy     0.3555470411E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    101   -0.1000000000+201    0.3555470411E-04   -0.1000000000+201    0.5404769527E-02    0.7920948882E-01        15     3
 intlbfgs> largest atomic distance between images is     0.3871682123     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11439E-03 d,cutoff=     3.3302         3.3508     max grad=    0.79751E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133132593        0.9022143625E-02
 intlbfgs> Highest QCI image energy=    0.1232256143E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1232256143E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    102   -0.1000000000+201    0.1143876682E-03   -0.1000000000+201    0.7975075850E-02    0.7918064326E-01        15     3
 intlbfgs> largest atomic distance between images is     0.3871678324     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11446E-03 d,cutoff=     3.3301         3.3508     max grad=    0.79775E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133132366        0.9012849385E-02
 intlbfgs> Highest QCI image energy=    0.1233052293E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1233052293E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    103   -0.1000000000+201    0.1144584791E-03   -0.1000000000+201    0.7977472415E-02    0.5378806074E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3871678861     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11445E-03 d,cutoff=     3.3301         3.3508     max grad=    0.79772E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133132389        0.9011310096E-02
 intlbfgs> Highest QCI image energy=    0.1232969240E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1232969240E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    104   -0.1000000000+201    0.1144515656E-03   -0.1000000000+201    0.7977204384E-02    0.6767530927E-06        15     3
 intlbfgs> Mean deviation     0.9011310096E-02 Decreasing QCI force constant to      2.434290506    
 intlbfgs> largest atomic distance between images is     0.3871682571     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11442E-03 d,cutoff=     3.3302         3.3508     max grad=    0.79757E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133132489        0.8993694643E-02
 intlbfgs> Highest QCI image energy=    0.1232617289E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1232617289E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    105   -0.1000000000+201    0.1144182383E-03   -0.1000000000+201    0.7975699374E-02    0.6309162885E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3871782620     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11372E-03 d,cutoff=     3.3302         3.3508     max grad=    0.79398E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133134807        0.8371987348E-02
 intlbfgs> Highest QCI image energy=    0.1225725350E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1225725350E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    106   -0.1000000000+201    0.1137183081E-03   -0.1000000000+201    0.7939790728E-02    0.2065283826E-03        15     3
 intlbfgs> largest atomic distance between images is     0.3871684951     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11441E-03 d,cutoff=     3.3302         3.3508     max grad=    0.79751E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133132513        0.8965336886E-02
 intlbfgs> Highest QCI image energy=    0.1232536505E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1232536505E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    107   -0.1000000000+201    0.1144122366E-03   -0.1000000000+201    0.7975109734E-02    0.2004887265E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3871685567     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11440E-03 d,cutoff=     3.3302         3.3508     max grad=    0.79747E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133132549        0.8966967460E-02
 intlbfgs> Highest QCI image energy=    0.1232409619E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1232409619E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    108   -0.1000000000+201    0.1144013458E-03   -0.1000000000+201    0.7974731186E-02    0.8620885645E-06        15     3
 intlbfgs> largest atomic distance between images is     0.3871704772     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11402E-03 d,cutoff=     3.3302         3.3508     max grad=    0.79618E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133133732        0.9064145526E-02
 intlbfgs> Highest QCI image energy=    0.1228278860E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1228278860E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    109   -0.1000000000+201    0.1140160493E-03   -0.1000000000+201    0.7961780061E-02    0.2602413420E-04        15     3
 intlbfgs> Mean deviation     0.9064145526E-02 Decreasing QCI force constant to      2.410188620    
 intlbfgs> largest atomic distance between images is     0.3871705344     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11401E-03 d,cutoff=     3.3302         3.3508     max grad=    0.79616E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133133745        0.9064802726E-02
 intlbfgs> Highest QCI image energy=    0.1228234629E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1228234629E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    110   -0.1000000000+201    0.1140119127E-03   -0.1000000000+201    0.7961580941E-02    0.6744438343E-06        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3871703450     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11401E-03 d,cutoff=     3.3302         3.3508     max grad=    0.79618E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133133753        0.9067787021E-02
 intlbfgs> Highest QCI image energy=    0.1228205067E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1228205067E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    111   -0.1000000000+201    0.1140093572E-03   -0.1000000000+201    0.7961827322E-02    0.3728709926E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3871705350     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11400E-03 d,cutoff=     3.3302         3.3508     max grad=    0.79613E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133133777        0.9072709540E-02
 intlbfgs> Highest QCI image energy=    0.1228123359E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1228123359E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    112   -0.1000000000+201    0.1140016048E-03   -0.1000000000+201    0.7961326202E-02    0.2778503884E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3871710225     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11396E-03 d,cutoff=     3.3302         3.3508     max grad=    0.79595E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133133898        0.9088545042E-02
 intlbfgs> Highest QCI image energy=    0.1227701542E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1227701542E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    113   -0.1000000000+201    0.1139621506E-03   -0.1000000000+201    0.7959536211E-02    0.5716499549E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3871717593     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11387E-03 d,cutoff=     3.3302         3.3508     max grad=    0.79561E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133134173        0.9112729275E-02
 intlbfgs> Highest QCI image energy=    0.1226750238E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1226750238E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    114   -0.1000000000+201    0.1138735585E-03   -0.1000000000+201    0.7956076602E-02    0.7479517373E-05        15     3
 intlbfgs> Mean deviation     0.9112729275E-02 Decreasing QCI force constant to      2.386325366    
 intlbfgs> largest atomic distance between images is     0.3871728527     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11360E-03 d,cutoff=     3.3302         3.3508     max grad=    0.79473E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133135025        0.9141441868E-02
 intlbfgs> Highest QCI image energy=    0.1223809292E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1223809292E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    115   -0.1000000000+201    0.1136013975E-03   -0.1000000000+201    0.7947272051E-02    0.1998064418E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3871758592     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11352E-03 d,cutoff=     3.3302         3.3508     max grad=    0.79405E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133135279        0.9236810669E-02
 intlbfgs> Highest QCI image energy=    0.1223009887E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1223009887E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    116   -0.1000000000+201    0.1135231085E-03   -0.1000000000+201    0.7940495203E-02    0.4907010111E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3871760494     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11305E-03 d,cutoff=     3.3303         3.3508     max grad=    0.79279E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133136761        0.9191266652E-02
 intlbfgs> Highest QCI image energy=    0.1217880965E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1217880965E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    117   -0.1000000000+201    0.1130543884E-03   -0.1000000000+201    0.7927888865E-02    0.5951493273E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3871749131     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11322E-03 d,cutoff=     3.3303         3.3508     max grad=    0.79341E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133136220        0.9206286247E-02
 intlbfgs> Highest QCI image energy=    0.1219718490E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1219718490E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    118   -0.1000000000+201    0.1132205774E-03   -0.1000000000+201    0.7934134432E-02    0.1395489143E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3871752217     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11319E-03 d,cutoff=     3.3303         3.3508     max grad=    0.79327E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133136333        0.9214384812E-02
 intlbfgs> Highest QCI image energy=    0.1219332712E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1219332712E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    119   -0.1000000000+201    0.1131859437E-03   -0.1000000000+201    0.7932740793E-02    0.2986679206E-05        15     3
 intlbfgs> Mean deviation     0.9214384812E-02 Decreasing QCI force constant to      2.362698382    
 intlbfgs> largest atomic distance between images is     0.3871752015     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11319E-03 d,cutoff=     3.3303         3.3508     max grad=    0.79328E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133136332        0.9213877360E-02
 intlbfgs> Highest QCI image energy=    0.1219336198E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1219336198E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    120   -0.1000000000+201    0.1131861471E-03   -0.1000000000+201    0.7932774457E-02    0.2908751765E-06        15     3
 intlbfgs> largest atomic distance between images is     0.3871729247     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11317E-03 d,cutoff=     3.3303         3.3508     max grad=    0.79354E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133136361        0.9154993775E-02
 intlbfgs> Highest QCI image energy=    0.1219277000E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1219277000E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    121   -0.1000000000+201    0.1131659663E-03   -0.1000000000+201    0.7935376819E-02    0.3674362181E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3871751855     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11319E-03 d,cutoff=     3.3303         3.3508     max grad=    0.79328E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133136333        0.9213306803E-02
 intlbfgs> Highest QCI image energy=    0.1219331384E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1219331384E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    122   -0.1000000000+201    0.1131856707E-03   -0.1000000000+201    0.7932782121E-02    0.3643190707E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3871751890     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11319E-03 d,cutoff=     3.3303         3.3508     max grad=    0.79328E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133136334        0.9213387150E-02
 intlbfgs> Highest QCI image energy=    0.1219327179E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1219327179E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    123   -0.1000000000+201    0.1131852754E-03   -0.1000000000+201    0.7932766524E-02    0.3334821056E-07        15     3
 intlbfgs> largest atomic distance between images is     0.3871775393     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11283E-03 d,cutoff=     3.3303         3.3508     max grad=    0.79200E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133137448        0.9276220885E-02
 intlbfgs> Highest QCI image energy=    0.1215553251E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1215553251E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    124   -0.1000000000+201    0.1128345380E-03   -0.1000000000+201    0.7920001158E-02    0.2398033691E-04        15     3
 intlbfgs> Mean deviation     0.9276220885E-02 Decreasing QCI force constant to      2.339305329    
 intlbfgs> largest atomic distance between images is     0.3871775662     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11277E-03 d,cutoff=     3.3303         3.3508     max grad=    0.79182E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133137653        0.9287671273E-02
 intlbfgs> Highest QCI image energy=    0.1214858215E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1214858215E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    125   -0.1000000000+201    0.1127708841E-03   -0.1000000000+201    0.7918235646E-02    0.6590577983E-05        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3871788693     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11276E-03 d,cutoff=     3.3303         3.3508     max grad=    0.79161E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133137694        0.9297253487E-02
 intlbfgs> Highest QCI image energy=    0.1214730802E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1214730802E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    126   -0.1000000000+201    0.1127583540E-03   -0.1000000000+201    0.7916093084E-02    0.1849760806E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3871778139     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11275E-03 d,cutoff=     3.3303         3.3508     max grad=    0.79173E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133137741        0.9302568874E-02
 intlbfgs> Highest QCI image energy=    0.1214562775E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1214562775E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    127   -0.1000000000+201    0.1127467803E-03   -0.1000000000+201    0.7917254560E-02    0.1743250421E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3871778274     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11272E-03 d,cutoff=     3.3303         3.3508     max grad=    0.79165E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133137825        0.9309871823E-02
 intlbfgs> Highest QCI image energy=    0.1214280819E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1214280819E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    128   -0.1000000000+201    0.1127208043E-03   -0.1000000000+201    0.7916540738E-02    0.2711416098E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3871785959     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11251E-03 d,cutoff=     3.3303         3.3508     max grad=    0.79098E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133138492        0.9354687139E-02
 intlbfgs> Highest QCI image energy=    0.1212040855E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1212040855E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    129   -0.1000000000+201    0.1125118881E-03   -0.1000000000+201    0.7909835199E-02    0.1505685480E-04        15     3
 intlbfgs> Mean deviation     0.9354687139E-02 Decreasing QCI force constant to      2.316143890    
 intlbfgs> largest atomic distance between images is     0.3871799183     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11235E-03 d,cutoff=     3.3303         3.3508     max grad=    0.79037E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133138989        0.9367970029E-02
 intlbfgs> Highest QCI image energy=    0.1210375340E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1210375340E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    130   -0.1000000000+201    0.1123546019E-03   -0.1000000000+201    0.7903673921E-02    0.1310598662E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3871788654     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11227E-03 d,cutoff=     3.3303         3.3508     max grad=    0.79031E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133139257        0.9408520939E-02
 intlbfgs> Highest QCI image energy=    0.1209501048E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1209501048E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    131   -0.1000000000+201    0.1122745507E-03   -0.1000000000+201    0.7903064102E-02    0.2403461474E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3871809407     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11208E-03 d,cutoff=     3.3304         3.3508     max grad=    0.78948E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133139828        0.9387275524E-02
 intlbfgs> Highest QCI image energy=    0.1207587992E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1207587992E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    132   -0.1000000000+201    0.1120827792E-03   -0.1000000000+201    0.7894760561E-02    0.2665797898E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3871817867     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11201E-03 d,cutoff=     3.3304         3.3508     max grad=    0.78916E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133140095        0.9408642910E-02
 intlbfgs> Highest QCI image energy=    0.1206699828E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1206699828E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    133   -0.1000000000+201    0.1120096153E-03   -0.1000000000+201    0.7891612193E-02    0.7989159257E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3871823286     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11193E-03 d,cutoff=     3.3304         3.3508     max grad=    0.78888E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133140363        0.9440617127E-02
 intlbfgs> Highest QCI image energy=    0.1205812603E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1205812603E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    134   -0.1000000000+201    0.1119305342E-03   -0.1000000000+201    0.7888776569E-02    0.7140107829E-05        15     3
 intlbfgs> Mean deviation     0.9440617127E-02 Decreasing QCI force constant to      2.293211772    
 intlbfgs> largest atomic distance between images is     0.3871823193     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11193E-03 d,cutoff=     3.3304         3.3508     max grad=    0.78889E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133140355        0.9440924193E-02
 intlbfgs> Highest QCI image energy=    0.1205840207E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1205840207E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    135   -0.1000000000+201    0.1119338472E-03   -0.1000000000+201    0.7888887268E-02    0.5403736757E-06        15     3
 intlbfgs> largest atomic distance between images is     0.3871823828     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11193E-03 d,cutoff=     3.3304         3.3508     max grad=    0.78889E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133140366        0.9448605907E-02
 intlbfgs> Highest QCI image energy=    0.1205803790E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1205803790E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    136   -0.1000000000+201    0.1119348362E-03   -0.1000000000+201    0.7888878393E-02    0.3380260871E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3871824699     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11192E-03 d,cutoff=     3.3304         3.3508     max grad=    0.78883E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133140404        0.9454648338E-02
 intlbfgs> Highest QCI image energy=    0.1205676883E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1205676883E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    137   -0.1000000000+201    0.1119194826E-03   -0.1000000000+201    0.7888329416E-02    0.2060344275E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3871831736     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11179E-03 d,cutoff=     3.3304         3.3508     max grad=    0.78838E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133140782        0.9487951202E-02
 intlbfgs> Highest QCI image energy=    0.1204429582E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1204429582E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    138   -0.1000000000+201    0.1117894517E-03   -0.1000000000+201    0.7883753269E-02    0.1086695572E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3871840081     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11164E-03 d,cutoff=     3.3304         3.3508     max grad=    0.78784E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133141270        0.9514656701E-02
 intlbfgs> Highest QCI image energy=    0.1202827293E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1202827293E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    139   -0.1000000000+201    0.1116372586E-03   -0.1000000000+201    0.7878418873E-02    0.1016578408E-04        15     3
 intlbfgs> Mean deviation     0.9514656701E-02 Decreasing QCI force constant to      2.270506705    
 intlbfgs> largest atomic distance between images is     0.3871847093     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11151E-03 d,cutoff=     3.3304         3.3508     max grad=    0.78741E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133141734        0.9518148186E-02
 intlbfgs> Highest QCI image energy=    0.1201304338E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1201304338E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    140   -0.1000000000+201    0.1115127024E-03   -0.1000000000+201    0.7874092127E-02    0.1296963232E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3871857463     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11134E-03 d,cutoff=     3.3304         3.3508     max grad=    0.78684E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133142698        0.9437327860E-02
 intlbfgs> Highest QCI image energy=    0.1198280700E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1198280700E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    141   -0.1000000000+201    0.1113449089E-03   -0.1000000000+201    0.7868447051E-02    0.6447391216E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3871845392     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11153E-03 d,cutoff=     3.3304         3.3508     max grad=    0.78749E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133141716        0.9491891326E-02
 intlbfgs> Highest QCI image energy=    0.1201363963E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1201363963E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    142   -0.1000000000+201    0.1115324417E-03   -0.1000000000+201    0.7874877314E-02    0.5719817219E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3871847733     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11149E-03 d,cutoff=     3.3304         3.3508     max grad=    0.78735E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133141828        0.9506080839E-02
 intlbfgs> Highest QCI image energy=    0.1200995416E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1200995416E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    143   -0.1000000000+201    0.1114937638E-03   -0.1000000000+201    0.7873500149E-02    0.3287252712E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3871869576     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11113E-03 d,cutoff=     3.3305         3.3508     max grad=    0.78604E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133142999        0.9599135882E-02
 intlbfgs> Highest QCI image energy=    0.1197181696E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1197181696E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    144   -0.1000000000+201    0.1111254562E-03   -0.1000000000+201    0.7860418799E-02    0.2523870600E-04        15     3
 intlbfgs> Mean deviation     0.9599135882E-02 Decreasing QCI force constant to      2.248026441    
 intlbfgs> largest atomic distance between images is     0.3871871433     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11109E-03 d,cutoff=     3.3305         3.3508     max grad=    0.78592E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133143131        0.9596123346E-02
 intlbfgs> Highest QCI image energy=    0.1196753374E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1196753374E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    145   -0.1000000000+201    0.1110903483E-03   -0.1000000000+201    0.7859191713E-02    0.3634048792E-05        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3871874176     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11104E-03 d,cutoff=     3.3305         3.3508     max grad=    0.78576E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133143264        0.9612697378E-02
 intlbfgs> Highest QCI image energy=    0.1196323694E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1196323694E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    146   -0.1000000000+201    0.1110449779E-03   -0.1000000000+201    0.7857567666E-02    0.3994643320E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3871894873     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11068E-03 d,cutoff=     3.3305         3.3508     max grad=    0.78445E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133144525        0.9653076441E-02
 intlbfgs> Highest QCI image energy=    0.1192261338E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1192261338E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    147   -0.1000000000+201    0.1106756124E-03   -0.1000000000+201    0.7844500366E-02    0.2643777089E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3871895751     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11067E-03 d,cutoff=     3.3305         3.3508     max grad=    0.78442E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133144546        0.9672712592E-02
 intlbfgs> Highest QCI image energy=    0.1192191789E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1192191789E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    148   -0.1000000000+201    0.1106652140E-03   -0.1000000000+201    0.7844179912E-02    0.6088868986E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3871895784     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11067E-03 d,cutoff=     3.3305         3.3508     max grad=    0.78442E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133144549        0.9672204936E-02
 intlbfgs> Highest QCI image energy=    0.1192179904E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1192179904E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    149   -0.1000000000+201    0.1106662765E-03   -0.1000000000+201    0.7844211514E-02    0.1373810892E-05        15     3
 intlbfgs> Mean deviation     0.9672204936E-02 Decreasing QCI force constant to      2.225768753    
 intlbfgs> largest atomic distance between images is     0.3871895800     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11067E-03 d,cutoff=     3.3305         3.3508     max grad=    0.78442E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133144551        0.9672443656E-02
 intlbfgs> Highest QCI image energy=    0.1192173943E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1192173943E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    150   -0.1000000000+201    0.1106654499E-03   -0.1000000000+201    0.7844188030E-02    0.8333459325E-07        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3871895878     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11067E-03 d,cutoff=     3.3305         3.3508     max grad=    0.78442E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133144553        0.9671923321E-02
 intlbfgs> Highest QCI image energy=    0.1192168110E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1192168110E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    151   -0.1000000000+201    0.1106659350E-03   -0.1000000000+201    0.7844186292E-02    0.2960301437E-06        15     3
 intlbfgs> largest atomic distance between images is     0.3871897521     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11064E-03 d,cutoff=     3.3305         3.3508     max grad=    0.78432E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133144668        0.9670136054E-02
 intlbfgs> Highest QCI image energy=    0.1191800753E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1191800753E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    152   -0.1000000000+201    0.1106383378E-03   -0.1000000000+201    0.7843203133E-02    0.3746017902E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3871907669     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11046E-03 d,cutoff=     3.3305         3.3508     max grad=    0.78370E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133145300        0.9684083450E-02
 intlbfgs> Highest QCI image energy=    0.1189782123E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1189782123E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    153   -0.1000000000+201    0.1104641701E-03   -0.1000000000+201    0.7837018608E-02    0.1391774658E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3871916388     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11031E-03 d,cutoff=     3.3305         3.3508     max grad=    0.78317E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133145792        0.9716401096E-02
 intlbfgs> Highest QCI image energy=    0.1188212762E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1188212762E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    154   -0.1000000000+201    0.1103142409E-03   -0.1000000000+201    0.7831697727E-02    0.1006681149E-04        15     3
 intlbfgs> Mean deviation     0.9716401096E-02 Decreasing QCI force constant to      2.203731439    
 intlbfgs> largest atomic distance between images is     0.3871920331     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11024E-03 d,cutoff=     3.3305         3.3508     max grad=    0.78291E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133145990        0.9749770072E-02
 intlbfgs> Highest QCI image energy=    0.1187579800E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1187579800E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    155   -0.1000000000+201    0.1102390365E-03   -0.1000000000+201    0.7829102038E-02    0.8309998350E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3871979679     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10905E-03 d,cutoff=     3.3306         3.3508     max grad=    0.77884E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133148915        0.1044732317E-01
 intlbfgs> Highest QCI image energy=    0.1179322171E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1179322171E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    156   -0.1000000000+201    0.1090472039E-03   -0.1000000000+201    0.7788426141E-02    0.1857427338E-03        15     3
 intlbfgs> largest atomic distance between images is     0.3871921478     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11021E-03 d,cutoff=     3.3305         3.3508     max grad=    0.78282E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133146023        0.9775702263E-02
 intlbfgs> Highest QCI image energy=    0.1187476760E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1187476760E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    157   -0.1000000000+201    0.1102120151E-03   -0.1000000000+201    0.7828216850E-02    0.1782437064E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3871922721     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.11019E-03 d,cutoff=     3.3305         3.3508     max grad=    0.78275E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133146100        0.9777903847E-02
 intlbfgs> Highest QCI image energy=    0.1187231512E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1187231512E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    158   -0.1000000000+201    0.1101908007E-03   -0.1000000000+201    0.7827461394E-02    0.1661382475E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3871944956     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10981E-03 d,cutoff=     3.3306         3.3508     max grad=    0.78140E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133147447        0.9828852665E-02
 intlbfgs> Highest QCI image energy=    0.1182975187E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1182975187E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    159   -0.1000000000+201    0.1098120505E-03   -0.1000000000+201    0.7813965196E-02    0.2739108807E-04        15     3
 intlbfgs> Mean deviation     0.9828852665E-02 Decreasing QCI force constant to      2.181912316    
 intlbfgs> largest atomic distance between images is     0.3871945021     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10981E-03 d,cutoff=     3.3306         3.3508     max grad=    0.78139E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133147450        0.9829100014E-02
 intlbfgs> Highest QCI image energy=    0.1182967707E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1182967707E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    160   -0.1000000000+201    0.1098110491E-03   -0.1000000000+201    0.7813930835E-02    0.1267925799E-06        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3871944901     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10981E-03 d,cutoff=     3.3306         3.3508     max grad=    0.78140E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133147452        0.9828200353E-02
 intlbfgs> Highest QCI image energy=    0.1182960752E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1182960752E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    161   -0.1000000000+201    0.1098124948E-03   -0.1000000000+201    0.7813974062E-02    0.7919660429E-06        15     3
 intlbfgs> largest atomic distance between images is     0.3871945472     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10980E-03 d,cutoff=     3.3306         3.3508     max grad=    0.78137E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133147488        0.9826951247E-02
 intlbfgs> Highest QCI image energy=    0.1182848502E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1182848502E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    162   -0.1000000000+201    0.1098037176E-03   -0.1000000000+201    0.7813656520E-02    0.1121555695E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3871958669     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10959E-03 d,cutoff=     3.3306         3.3508     max grad=    0.78060E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133148269        0.9838304076E-02
 intlbfgs> Highest QCI image energy=    0.1180400456E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1180400456E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    163   -0.1000000000+201    0.1095898073E-03   -0.1000000000+201    0.7806000694E-02    0.1720364454E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3871966365     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10945E-03 d,cutoff=     3.3306         3.3508     max grad=    0.78012E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133148724        0.9870916248E-02
 intlbfgs> Highest QCI image energy=    0.1178978118E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1178978118E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    164   -0.1000000000+201    0.1094537325E-03   -0.1000000000+201    0.7801181532E-02    0.9247374028E-05        15     3
 intlbfgs> Mean deviation     0.9870916248E-02 Decreasing QCI force constant to      2.160309224    
 intlbfgs> largest atomic distance between images is     0.3871969901     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10938E-03 d,cutoff=     3.3306         3.3508     max grad=    0.77987E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133148930        0.9907805846E-02
 intlbfgs> Highest QCI image energy=    0.1178334601E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1178334601E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    165   -0.1000000000+201    0.1093809504E-03   -0.1000000000+201    0.7798658750E-02    0.8190186147E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3871996442     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10874E-03 d,cutoff=     3.3307         3.3508     max grad=    0.77768E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133150532        0.1039760006E-01
 intlbfgs> Highest QCI image energy=    0.1173728228E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1173728228E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    166   -0.1000000000+201    0.1087394571E-03   -0.1000000000+201    0.7776822204E-02    0.1157870340E-03        15     3
 intlbfgs> largest atomic distance between images is     0.3871970054     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10937E-03 d,cutoff=     3.3306         3.3508     max grad=    0.77982E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133148933        0.9933835803E-02
 intlbfgs> Highest QCI image energy=    0.1178325865E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1178325865E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    167   -0.1000000000+201    0.1093666200E-03   -0.1000000000+201    0.7798213378E-02    0.1088678739E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3871971433     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10934E-03 d,cutoff=     3.3306         3.3508     max grad=    0.77974E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133149019        0.9935596453E-02
 intlbfgs> Highest QCI image energy=    0.1178057249E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1178057249E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    168   -0.1000000000+201    0.1093435644E-03   -0.1000000000+201    0.7797388876E-02    0.1899361864E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3871994517     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10896E-03 d,cutoff=     3.3306         3.3508     max grad=    0.77835E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133150415        0.9986667266E-02
 intlbfgs> Highest QCI image energy=    0.1173732563E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1173732563E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    169   -0.1000000000+201    0.1089552725E-03   -0.1000000000+201    0.7783504583E-02    0.2781048768E-04        15     3
 intlbfgs> Mean deviation     0.9986667266E-02 Decreasing QCI force constant to      2.138920023    
 intlbfgs> largest atomic distance between images is     0.3871994879     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10895E-03 d,cutoff=     3.3306         3.3508     max grad=    0.77833E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133150430        0.9987837781E-02
 intlbfgs> Highest QCI image energy=    0.1173687319E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1173687319E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    170   -0.1000000000+201    0.1089497722E-03   -0.1000000000+201    0.7783310201E-02    0.6082271939E-06        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3871994671     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10895E-03 d,cutoff=     3.3306         3.3508     max grad=    0.77834E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133150443        0.9985544213E-02
 intlbfgs> Highest QCI image energy=    0.1173648645E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1173648645E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    171   -0.1000000000+201    0.1089515132E-03   -0.1000000000+201    0.7783362614E-02    0.2214133782E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3871996645     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10892E-03 d,cutoff=     3.3307         3.3508     max grad=    0.77824E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133150541        0.9983032817E-02
 intlbfgs> Highest QCI image energy=    0.1173344707E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1173344707E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    172   -0.1000000000+201    0.1089236685E-03   -0.1000000000+201    0.7782351859E-02    0.2462682844E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3872016693     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10860E-03 d,cutoff=     3.3307         3.3508     max grad=    0.77708E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133151668        0.1001772750E-01
 intlbfgs> Highest QCI image energy=    0.1169889036E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1169889036E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    173   -0.1000000000+201    0.1086009299E-03   -0.1000000000+201    0.7770805315E-02    0.2236201819E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872020139     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10853E-03 d,cutoff=     3.3307         3.3508     max grad=    0.77682E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133151917        0.1005044848E-01
 intlbfgs> Highest QCI image energy=    0.1169125089E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1169125089E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    174   -0.1000000000+201    0.1085276819E-03   -0.1000000000+201    0.7768228310E-02    0.6360060404E-05        15     3
 intlbfgs> Mean deviation     0.1005044848E-01 Decreasing QCI force constant to      2.117742597    
 intlbfgs> largest atomic distance between images is     0.3872020105     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10852E-03 d,cutoff=     3.3307         3.3508     max grad=    0.77678E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133151953        0.1006762146E-01
 intlbfgs> Highest QCI image energy=    0.1169016451E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1169016451E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    175   -0.1000000000+201    0.1085161546E-03   -0.1000000000+201    0.7767849753E-02    0.3275082558E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3871998466     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10816E-03 d,cutoff=     3.3307         3.3508     max grad=    0.77570E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133153178        0.1103706637E-01
 intlbfgs> Highest QCI image energy=    0.1166155019E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1166155019E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    176   -0.1000000000+201    0.1081579783E-03   -0.1000000000+201    0.7757033151E-02    0.1927477854E-03        15     3
 intlbfgs> largest atomic distance between images is     0.3872019476     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10852E-03 d,cutoff=     3.3307         3.3508     max grad=    0.77678E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133151950        0.1008277847E-01
 intlbfgs> Highest QCI image energy=    0.1169023192E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1169023192E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    177   -0.1000000000+201    0.1085151315E-03   -0.1000000000+201    0.7767843789E-02    0.1895606497E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3872019788     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10851E-03 d,cutoff=     3.3307         3.3508     max grad=    0.77677E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133151968        0.1008326839E-01
 intlbfgs> Highest QCI image energy=    0.1168967620E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1168967620E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    178   -0.1000000000+201    0.1085100123E-03   -0.1000000000+201    0.7767660623E-02    0.3624623505E-06        15     3
 intlbfgs> largest atomic distance between images is     0.3872045385     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10808E-03 d,cutoff=     3.3307         3.3508     max grad=    0.77523E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133153492        0.1014735774E-01
 intlbfgs> Highest QCI image energy=    0.1164340593E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1164340593E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    179   -0.1000000000+201    0.1080822004E-03   -0.1000000000+201    0.7752339090E-02    0.2928361320E-04        15     3
 intlbfgs> Mean deviation     0.1014735774E-01 Decreasing QCI force constant to      2.096774849    
 intlbfgs> largest atomic distance between images is     0.3872045426     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10808E-03 d,cutoff=     3.3307         3.3508     max grad=    0.77523E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133153494        0.1014813392E-01
 intlbfgs> Highest QCI image energy=    0.1164333439E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1164333439E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    180   -0.1000000000+201    0.1080815300E-03   -0.1000000000+201    0.7752318089E-02    0.2425035434E-06        15     3
 intlbfgs> largest atomic distance between images is     0.3872045479     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10808E-03 d,cutoff=     3.3307         3.3508     max grad=    0.77524E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133153495        0.1016861857E-01
 intlbfgs> Highest QCI image energy=    0.1164332146E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1164332146E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    181   -0.1000000000+201    0.1080811273E-03   -0.1000000000+201    0.7752395378E-02    0.7283346073E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3872045438     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10808E-03 d,cutoff=     3.3307         3.3508     max grad=    0.77523E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133153494        0.1014795723E-01
 intlbfgs> Highest QCI image energy=    0.1164335119E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1164335119E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    182   -0.1000000000+201    0.1080817445E-03   -0.1000000000+201    0.7752326144E-02    0.7210543732E-05        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3872045444     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10808E-03 d,cutoff=     3.3307         3.3508     max grad=    0.77523E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133153494        0.1014787972E-01
 intlbfgs> Highest QCI image energy=    0.1164333427E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1164333427E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    183   -0.1000000000+201    0.1080816066E-03   -0.1000000000+201    0.7752320678E-02    0.5081774383E-07        15     3
 intlbfgs> largest atomic distance between images is     0.3872047331     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10804E-03 d,cutoff=     3.3307         3.3508     max grad=    0.77509E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133153639        0.1014295689E-01
 intlbfgs> Highest QCI image energy=    0.1163897156E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1163897156E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    184   -0.1000000000+201    0.1080431839E-03   -0.1000000000+201    0.7750876450E-02    0.6784809316E-05        15     3
 intlbfgs> Mean deviation     0.1014295689E-01 Decreasing QCI force constant to      2.076014702    
 intlbfgs> largest atomic distance between images is     0.3872071552     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10763E-03 d,cutoff=     3.3308         3.3508     max grad=    0.77362E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133155114        0.1023459267E-01
 intlbfgs> Highest QCI image energy=    0.1159463213E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1159463213E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    185   -0.1000000000+201    0.1076293367E-03   -0.1000000000+201    0.7736180292E-02    0.2886811407E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3932215523     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     30 atoms      2    12 value=    0.53708E-05 d,cutoff=     2.7261         2.7298     max grad=    0.26681E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7155123772        0.1775001398    
 intlbfgs> Highest QCI image energy=    0.7164611925E-05 images=       1
 intlbfgs> Highest image        2 energy     0.7164611925E-05 is      0.000000000     sigma from the mean
 intlbfgs> steps:    186   -0.1000000000+201    0.5370799167E-05   -0.1000000000+201    0.2668065686E-02    0.5252170970E-01        15     3
 intlbfgs> largest atomic distance between images is     0.3872098732     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10717E-03 d,cutoff=     3.3308         3.3508     max grad=    0.77198E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133156771        0.1034018440E-01
 intlbfgs> Highest QCI image energy=    0.1154532815E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1154532815E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    187   -0.1000000000+201    0.1071679662E-03   -0.1000000000+201    0.7719786395E-02    0.5248909557E-01        15     3
 intlbfgs> largest atomic distance between images is     0.3872094264     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10725E-03 d,cutoff=     3.3308         3.3508     max grad=    0.77226E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133156480        0.1032273465E-01
 intlbfgs> Highest QCI image energy=    0.1155396982E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1155396982E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    188   -0.1000000000+201    0.1072491801E-03   -0.1000000000+201    0.7722640803E-02    0.5524888829E-05        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3872092561     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10728E-03 d,cutoff=     3.3308         3.3508     max grad=    0.77237E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133156366        0.1031402652E-01
 intlbfgs> Highest QCI image energy=    0.1155733350E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1155733350E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    189   -0.1000000000+201    0.1072813922E-03   -0.1000000000+201    0.7723748838E-02    0.2330053248E-05        15     3
 intlbfgs> Mean deviation     0.1031402652E-01 Decreasing QCI force constant to      2.055460101    
 intlbfgs> largest atomic distance between images is     0.3872096649     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10721E-03 d,cutoff=     3.3308         3.3508     max grad=    0.77211E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133156638        0.1030846717E-01
 intlbfgs> Highest QCI image energy=    0.1154926504E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1154926504E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    190   -0.1000000000+201    0.1072104970E-03   -0.1000000000+201    0.7721082825E-02    0.9320994906E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3872112180     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10698E-03 d,cutoff=     3.3308         3.3508     max grad=    0.77110E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133157711        0.1014004627E-01
 intlbfgs> Highest QCI image energy=    0.1151938866E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1151938866E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    191   -0.1000000000+201    0.1069811964E-03   -0.1000000000+201    0.7711032741E-02    0.8674793985E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872094949     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10723E-03 d,cutoff=     3.3308         3.3508     max grad=    0.77216E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133156585        0.1028984017E-01
 intlbfgs> Highest QCI image energy=    0.1155085424E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1155085424E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    192   -0.1000000000+201    0.1072255580E-03   -0.1000000000+201    0.7721625150E-02    0.7934137066E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3872097131     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10719E-03 d,cutoff=     3.3308         3.3508     max grad=    0.77203E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133156720        0.1030155114E-01
 intlbfgs> Highest QCI image energy=    0.1154683279E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1154683279E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    193   -0.1000000000+201    0.1071866957E-03   -0.1000000000+201    0.7720282689E-02    0.3205865770E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3872121601     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10678E-03 d,cutoff=     3.3308         3.3508     max grad=    0.77057E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133158194        0.1039237143E-01
 intlbfgs> Highest QCI image energy=    0.1150337492E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1150337492E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    194   -0.1000000000+201    0.1067813231E-03   -0.1000000000+201    0.7705709918E-02    0.2856537207E-04        15     3
 intlbfgs> Mean deviation     0.1039237143E-01 Decreasing QCI force constant to      2.035109011    
 intlbfgs> largest atomic distance between images is     0.3872122470     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10677E-03 d,cutoff=     3.3309         3.3508     max grad=    0.77051E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133158252        0.1039230435E-01
 intlbfgs> Highest QCI image energy=    0.1150168281E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1150168281E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    195   -0.1000000000+201    0.1067667183E-03   -0.1000000000+201    0.7705147267E-02    0.1864691932E-05        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3872123421     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10675E-03 d,cutoff=     3.3309         3.3508     max grad=    0.77046E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133158303        0.1040253050E-01
 intlbfgs> Highest QCI image energy=    0.1150019720E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1150019720E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    196   -0.1000000000+201    0.1067507598E-03   -0.1000000000+201    0.7704641177E-02    0.3615803160E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3872131262     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10662E-03 d,cutoff=     3.3309         3.3508     max grad=    0.77000E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133158774        0.1043504567E-01
 intlbfgs> Highest QCI image energy=    0.1148638580E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1148638580E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    197   -0.1000000000+201    0.1066248089E-03   -0.1000000000+201    0.7700031039E-02    0.9284346442E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3872147677     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10634E-03 d,cutoff=     3.3309         3.3508     max grad=    0.76897E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133159836        0.1048251266E-01
 intlbfgs> Highest QCI image energy=    0.1145544307E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1145544307E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    198   -0.1000000000+201    0.1063378861E-03   -0.1000000000+201    0.7689705645E-02    0.1994046892E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872148513     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10632E-03 d,cutoff=     3.3309         3.3508     max grad=    0.76892E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133159885        0.1047713993E-01
 intlbfgs> Highest QCI image energy=    0.1145400541E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1145400541E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    199   -0.1000000000+201    0.1063244191E-03   -0.1000000000+201    0.7689208654E-02    0.2408551085E-05        15     3
 intlbfgs> Mean deviation     0.1047713993E-01 Decreasing QCI force constant to      2.014959417    
 intlbfgs> largest atomic distance between images is     0.3872148465     for atom     10 and images      1     2 total images=     1
 checkrep> number of active repulsions and total=      69      69
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10633E-03 d,cutoff=     3.3309         3.3508     max grad=    0.76892E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133159882        0.1047496558E-01
 intlbfgs> Highest QCI image energy=    0.1145411182E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1145411182E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    200   -0.1000000000+201    0.1063251975E-03   -0.1000000000+201    0.7689240645E-02    0.5322363710E-06        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.3872149165     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10631E-03 d,cutoff=     3.3309         3.3508     max grad=    0.76889E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133159906        0.1040274701E-01
 intlbfgs> Highest QCI image energy=    0.1145352013E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1145352013E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    201   -0.1000000000+201    0.1063122500E-03   -0.1000000000+201    0.7688906047E-02    0.1949212064E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872148574     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10632E-03 d,cutoff=     3.3309         3.3508     max grad=    0.76892E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133159888        0.1047284665E-01
 intlbfgs> Highest QCI image energy=    0.1145393895E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1145393895E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    202   -0.1000000000+201    0.1063235509E-03   -0.1000000000+201    0.7689180968E-02    0.1885234731E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872148656     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10632E-03 d,cutoff=     3.3309         3.3508     max grad=    0.76891E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133159893        0.1047377606E-01
 intlbfgs> Highest QCI image energy=    0.1145378844E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1145378844E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    203   -0.1000000000+201    0.1063221680E-03   -0.1000000000+201    0.7689129448E-02    0.1960195100E-06        15     3
 intlbfgs> largest atomic distance between images is     0.3872160354     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10612E-03 d,cutoff=     3.3309         3.3508     max grad=    0.76818E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133160639        0.1055208162E-01
 intlbfgs> Highest QCI image energy=    0.1143217305E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1143217305E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    204   -0.1000000000+201    0.1061228020E-03   -0.1000000000+201    0.7681841129E-02    0.1729035512E-04        15     3
 intlbfgs> Mean deviation     0.1055208162E-01 Decreasing QCI force constant to      1.995009323    
 intlbfgs> largest atomic distance between images is     0.3872174598     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10588E-03 d,cutoff=     3.3309         3.3508     max grad=    0.76732E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133161545        0.1055823376E-01
 intlbfgs> Highest QCI image energy=    0.1140605441E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1140605441E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    205   -0.1000000000+201    0.1058793866E-03   -0.1000000000+201    0.7673170135E-02    0.1931052775E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3872182816     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10574E-03 d,cutoff=     3.3309         3.3508     max grad=    0.76677E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133162120        0.1073401249E-01
 intlbfgs> Highest QCI image energy=    0.1138984215E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1138984215E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    206   -0.1000000000+201    0.1057364791E-03   -0.1000000000+201    0.7667698561E-02    0.3911879033E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872201675     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10540E-03 d,cutoff=     3.3310         3.3508     max grad=    0.76560E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133163401        0.1065121491E-01
 intlbfgs> Highest QCI image energy=    0.1135296858E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1135296858E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    207   -0.1000000000+201    0.1053960424E-03   -0.1000000000+201    0.7655971944E-02    0.4466385237E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872200459     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10545E-03 d,cutoff=     3.3310         3.3508     max grad=    0.76575E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133163162        0.1063587484E-01
 intlbfgs> Highest QCI image energy=    0.1135976761E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1135976761E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    208   -0.1000000000+201    0.1054484650E-03   -0.1000000000+201    0.7657543538E-02    0.8095310629E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3872200849     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10544E-03 d,cutoff=     3.3310         3.3508     max grad=    0.76572E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133163200        0.1064058250E-01
 intlbfgs> Highest QCI image energy=    0.1135868050E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1135868050E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    209   -0.1000000000+201    0.1054395716E-03   -0.1000000000+201    0.7657236157E-02    0.1188871876E-05        15     3
 intlbfgs> Mean deviation     0.1064058250E-01 Decreasing QCI force constant to      1.975256756    
 intlbfgs> largest atomic distance between images is     0.3872200991     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10544E-03 d,cutoff=     3.3310         3.3508     max grad=    0.76571E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133163208        0.1064116741E-01
 intlbfgs> Highest QCI image energy=    0.1135844954E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1135844954E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    210   -0.1000000000+201    0.1054372274E-03   -0.1000000000+201    0.7657149285E-02    0.1905554669E-06        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3872201104     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10544E-03 d,cutoff=     3.3310         3.3508     max grad=    0.76571E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133163216        0.1064156512E-01
 intlbfgs> Highest QCI image energy=    0.1135821746E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1135821746E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    211   -0.1000000000+201    0.1054350729E-03   -0.1000000000+201    0.7657073344E-02    0.1564948105E-06        15     3
 intlbfgs> largest atomic distance between images is     0.3872226603     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10500E-03 d,cutoff=     3.3310         3.3508     max grad=    0.76413E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133164874        0.1072450720E-01
 intlbfgs> Highest QCI image energy=    0.1131125816E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1131125816E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    212   -0.1000000000+201    0.1049984235E-03   -0.1000000000+201    0.7641277296E-02    0.3006572030E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872227349     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10499E-03 d,cutoff=     3.3310         3.3508     max grad=    0.76410E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133164905        0.1072491730E-01
 intlbfgs> Highest QCI image energy=    0.1131039156E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1131039156E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    213   -0.1000000000+201    0.1049917295E-03   -0.1000000000+201    0.7641007419E-02    0.1910283010E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3872227574     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10499E-03 d,cutoff=     3.3310         3.3508     max grad=    0.76409E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133164907        0.1072547595E-01
 intlbfgs> Highest QCI image energy=    0.1131032744E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1131032744E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    214   -0.1000000000+201    0.1049900785E-03   -0.1000000000+201    0.7640932628E-02    0.5480797847E-06        15     3
 intlbfgs> Mean deviation     0.1072547595E-01 Decreasing QCI force constant to      1.955699758    
 intlbfgs> largest atomic distance between images is     0.3872227491     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10499E-03 d,cutoff=     3.3310         3.3508     max grad=    0.76410E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133164905        0.1072504949E-01
 intlbfgs> Highest QCI image energy=    0.1131037099E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1131037099E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    215   -0.1000000000+201    0.1049909559E-03   -0.1000000000+201    0.7640969585E-02    0.2324463123E-06        15     3
 intlbfgs> largest atomic distance between images is     0.3872223944     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10502E-03 d,cutoff=     3.3310         3.3508     max grad=    0.76423E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133164915        0.1070390500E-01
 intlbfgs> Highest QCI image energy=    0.1131015952E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1131015952E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    216   -0.1000000000+201    0.1050181088E-03   -0.1000000000+201    0.7642270854E-02    0.1421986773E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872227449     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10499E-03 d,cutoff=     3.3310         3.3508     max grad=    0.76410E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133164908        0.1072476110E-01
 intlbfgs> Highest QCI image energy=    0.1131030838E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1131030838E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    217   -0.1000000000+201    0.1049909872E-03   -0.1000000000+201    0.7640976506E-02    0.1393554009E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872227502     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10499E-03 d,cutoff=     3.3310         3.3508     max grad=    0.76409E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133164910        0.1072495130E-01
 intlbfgs> Highest QCI image energy=    0.1131025103E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1131025103E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    218   -0.1000000000+201    0.1049902955E-03   -0.1000000000+201    0.7640949913E-02    0.8467200705E-07        15     3
 intlbfgs> largest atomic distance between images is     0.3872238861     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10483E-03 d,cutoff=     3.3310         3.3508     max grad=    0.76349E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133165459        0.1076126908E-01
 intlbfgs> Highest QCI image energy=    0.1129481485E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1129481485E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    219   -0.1000000000+201    0.1048277060E-03   -0.1000000000+201    0.7634866145E-02    0.1365323411E-04        15     3
 intlbfgs> Mean deviation     0.1076126908E-01 Decreasing QCI force constant to      1.936336394    
 intlbfgs> largest atomic distance between images is     0.3872253897     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10455E-03 d,cutoff=     3.3311         3.3508     max grad=    0.76249E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133166597        0.1080693352E-01
 intlbfgs> Highest QCI image energy=    0.1126291504E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1126291504E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    220   -0.1000000000+201    0.1045489925E-03   -0.1000000000+201    0.7624923689E-02    0.2199500152E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3872292909     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10397E-03 d,cutoff=     3.3311         3.3508     max grad=    0.76034E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133168598        0.1093558073E-01
 intlbfgs> Highest QCI image energy=    0.1120760571E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1120760571E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    221   -0.1000000000+201    0.1039734871E-03   -0.1000000000+201    0.7603435553E-02    0.4598217145E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872291613     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10384E-03 d,cutoff=     3.3311         3.3508     max grad=    0.75997E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133169527        0.1092176140E-01
 intlbfgs> Highest QCI image energy=    0.1118193941E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1118193941E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    222   -0.1000000000+201    0.1038406571E-03   -0.1000000000+201    0.7599668167E-02    0.5380797693E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872278270     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10414E-03 d,cutoff=     3.3311         3.3508     max grad=    0.76100E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133168204        0.1088520321E-01
 intlbfgs> Highest QCI image energy=    0.1121825049E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1121825049E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    223   -0.1000000000+201    0.1041380365E-03   -0.1000000000+201    0.7609953632E-02    0.3170654241E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872281481     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10409E-03 d,cutoff=     3.3311         3.3508     max grad=    0.76081E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133168390        0.1089517875E-01
 intlbfgs> Highest QCI image energy=    0.1121312122E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1121312122E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    224   -0.1000000000+201    0.1040873836E-03   -0.1000000000+201    0.7608094664E-02    0.3527559944E-05        15     3
 intlbfgs> Mean deviation     0.1089517875E-01 Decreasing QCI force constant to      1.917164747    
 intlbfgs> largest atomic distance between images is     0.3872281008     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10409E-03 d,cutoff=     3.3311         3.3508     max grad=    0.76083E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133168369        0.1089413345E-01
 intlbfgs> Highest QCI image energy=    0.1121370148E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1121370148E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    225   -0.1000000000+201    0.1040935771E-03   -0.1000000000+201    0.7608330304E-02    0.5235015009E-06        15     3
 intlbfgs> largest atomic distance between images is     0.3872281245     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10409E-03 d,cutoff=     3.3311         3.3508     max grad=    0.76082E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133168390        0.1089478839E-01
 intlbfgs> Highest QCI image energy=    0.1121312265E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1121312265E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    226   -0.1000000000+201    0.1040887037E-03   -0.1000000000+201    0.7608159711E-02    0.4590809398E-06        15     3
 intlbfgs> largest atomic distance between images is     0.3872312369     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10360E-03 d,cutoff=     3.3311         3.3508     max grad=    0.75901E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133170268        0.1097365866E-01
 intlbfgs> Highest QCI image energy=    0.1116149461E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1116149461E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    227   -0.1000000000+201    0.1035971133E-03   -0.1000000000+201    0.7590127697E-02    0.3353793282E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872307949     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10364E-03 d,cutoff=     3.3311         3.3508     max grad=    0.75919E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133170140        0.1097846345E-01
 intlbfgs> Highest QCI image energy=    0.1116500366E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1116500366E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    228   -0.1000000000+201    0.1036431794E-03   -0.1000000000+201    0.7591895958E-02    0.5109339644E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3872308006     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10364E-03 d,cutoff=     3.3311         3.3508     max grad=    0.75919E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133170134        0.1097914378E-01
 intlbfgs> Highest QCI image energy=    0.1116516806E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1116516806E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    229   -0.1000000000+201    0.1036430068E-03   -0.1000000000+201    0.7591887964E-02    0.6822644816E-06        15     3
 intlbfgs> Mean deviation     0.1097914378E-01 Decreasing QCI force constant to      1.898182918    
 intlbfgs> largest atomic distance between images is     0.3872308013     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10364E-03 d,cutoff=     3.3311         3.3508     max grad=    0.75919E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133170136        0.1097941767E-01
 intlbfgs> Highest QCI image energy=    0.1116512265E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1116512265E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    230   -0.1000000000+201    0.1036426225E-03   -0.1000000000+201    0.7591874651E-02    0.4305276118E-07        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3872308049     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10364E-03 d,cutoff=     3.3311         3.3508     max grad=    0.75919E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133170137        0.1097937780E-01
 intlbfgs> Highest QCI image energy=    0.1116507721E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1116507721E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    231   -0.1000000000+201    0.1036421788E-03   -0.1000000000+201    0.7591857929E-02    0.3436383540E-07        15     3
 intlbfgs> largest atomic distance between images is     0.3872333997     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10315E-03 d,cutoff=     3.3312         3.3508     max grad=    0.75740E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133172120        0.1111630387E-01
 intlbfgs> Highest QCI image energy=    0.1111112583E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1111112583E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    232   -0.1000000000+201    0.1031511001E-03   -0.1000000000+201    0.7574023159E-02    0.3565023280E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872336366     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10318E-03 d,cutoff=     3.3312         3.3508     max grad=    0.75751E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133171943        0.1105626377E-01
 intlbfgs> Highest QCI image energy=    0.1111592759E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1111592759E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    233   -0.1000000000+201    0.1031833343E-03   -0.1000000000+201    0.7575053987E-02    0.9747743262E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3872335114     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10319E-03 d,cutoff=     3.3312         3.3508     max grad=    0.75754E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133171921        0.1106518128E-01
 intlbfgs> Highest QCI image energy=    0.1111650608E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1111650608E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    234   -0.1000000000+201    0.1031913814E-03   -0.1000000000+201    0.7575369680E-02    0.1705294436E-05        15     3
 intlbfgs> Mean deviation     0.1106518128E-01 Decreasing QCI force constant to      1.879389027    
 intlbfgs> largest atomic distance between images is     0.3872335179     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10319E-03 d,cutoff=     3.3312         3.3508     max grad=    0.75753E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133171926        0.1106526969E-01
 intlbfgs> Highest QCI image energy=    0.1111637449E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1111637449E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    235   -0.1000000000+201    0.1031900852E-03   -0.1000000000+201    0.7575326118E-02    0.9830516367E-07        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3872335227     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10319E-03 d,cutoff=     3.3312         3.3508     max grad=    0.75753E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133171931        0.1106560122E-01
 intlbfgs> Highest QCI image energy=    0.1111624252E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1111624252E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    236   -0.1000000000+201    0.1031888571E-03   -0.1000000000+201    0.7575284632E-02    0.8957142603E-07        15     3
 intlbfgs> largest atomic distance between images is     0.3872362015     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10274E-03 d,cutoff=     3.3312         3.3508     max grad=    0.75587E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133173750        0.1116190264E-01
 intlbfgs> Highest QCI image energy=    0.1106721337E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1106721337E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    237   -0.1000000000+201    0.1027361415E-03   -0.1000000000+201    0.7558650556E-02    0.3176888694E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872362488     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10273E-03 d,cutoff=     3.3312         3.3508     max grad=    0.75587E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133173742        0.1114992206E-01
 intlbfgs> Highest QCI image energy=    0.1106742429E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1106742429E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    238   -0.1000000000+201    0.1027349806E-03   -0.1000000000+201    0.7558681820E-02    0.2349478887E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3872362514     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10274E-03 d,cutoff=     3.3312         3.3508     max grad=    0.75587E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133173740        0.1115154677E-01
 intlbfgs> Highest QCI image energy=    0.1106747133E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1106747133E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    239   -0.1000000000+201    0.1027361326E-03   -0.1000000000+201    0.7558687753E-02    0.5306474001E-06        15     3
 intlbfgs> Mean deviation     0.1115154677E-01 Decreasing QCI force constant to      1.860781215    
 intlbfgs> largest atomic distance between images is     0.3872362524     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10274E-03 d,cutoff=     3.3312         3.3508     max grad=    0.75587E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133173740        0.1115153462E-01
 intlbfgs> Highest QCI image energy=    0.1106746718E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1106746718E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    240   -0.1000000000+201    0.1027360728E-03   -0.1000000000+201    0.7558685272E-02    0.9268612288E-08        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3872362457     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10274E-03 d,cutoff=     3.3312         3.3508     max grad=    0.75587E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133173741        0.1115173543E-01
 intlbfgs> Highest QCI image energy=    0.1106746307E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1106746307E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    241   -0.1000000000+201    0.1027362413E-03   -0.1000000000+201    0.7558694519E-02    0.8751275302E-07        15     3
 intlbfgs> largest atomic distance between images is     0.3872361950     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10273E-03 d,cutoff=     3.3312         3.3508     max grad=    0.75586E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133173762        0.1115480296E-01
 intlbfgs> Highest QCI image energy=    0.1106688131E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1106688131E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    242   -0.1000000000+201    0.1027322421E-03   -0.1000000000+201    0.7558608190E-02    0.9737865265E-06        15     3
 intlbfgs> largest atomic distance between images is     0.3872360753     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10263E-03 d,cutoff=     3.3312         3.3508     max grad=    0.75555E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133174223        0.1119644034E-01
 intlbfgs> Highest QCI image energy=    0.1105455027E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1105455027E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    243   -0.1000000000+201    0.1026314715E-03   -0.1000000000+201    0.7555493603E-02    0.1177311872E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872366946     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10249E-03 d,cutoff=     3.3313         3.3508     max grad=    0.75506E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133174795        0.1122873267E-01
 intlbfgs> Highest QCI image energy=    0.1103929493E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1103929493E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    244   -0.1000000000+201    0.1024940932E-03   -0.1000000000+201    0.7550608435E-02    0.1016540218E-04        15     3
 intlbfgs> Mean deviation     0.1122873267E-01 Decreasing QCI force constant to      1.842357639    
 intlbfgs> largest atomic distance between images is     0.3872389938     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10228E-03 d,cutoff=     3.3313         3.3508     max grad=    0.75420E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133175577        0.1123725612E-01
 intlbfgs> Highest QCI image energy=    0.1101844922E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1101844922E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    245   -0.1000000000+201    0.1022808653E-03   -0.1000000000+201    0.7541977867E-02    0.1841180594E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872579931     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10106E-03 d,cutoff=     3.3314         3.3508     max grad=    0.74878E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133179817        0.1110711810E-01
 intlbfgs> Highest QCI image energy=    0.1091178650E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1091178650E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    246   -0.1000000000+201    0.1010579506E-03   -0.1000000000+201    0.7487779381E-02    0.1578925035E-03        15     3
 intlbfgs> largest atomic distance between images is     0.3872405236     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10223E-03 d,cutoff=     3.3313         3.3508     max grad=    0.75391E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133175686        0.1121009621E-01
 intlbfgs> Highest QCI image energy=    0.1101562615E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1101562615E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    247   -0.1000000000+201    0.1022296553E-03   -0.1000000000+201    0.7539119813E-02    0.1435087577E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3872406016     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10217E-03 d,cutoff=     3.3313         3.3508     max grad=    0.75371E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133175958        0.1122920163E-01
 intlbfgs> Highest QCI image energy=    0.1100837990E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1100837990E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    248   -0.1000000000+201    0.1021691379E-03   -0.1000000000+201    0.7537137764E-02    0.6085585193E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3872417307     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10183E-03 d,cutoff=     3.3313         3.3508     max grad=    0.75253E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133177424        0.1132412314E-01
 intlbfgs> Highest QCI image energy=    0.1096964206E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1096964206E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    249   -0.1000000000+201    0.1018284089E-03   -0.1000000000+201    0.7525329482E-02    0.2744142884E-04        15     3
 intlbfgs> Mean deviation     0.1132412314E-01 Decreasing QCI force constant to      1.824116474    
 intlbfgs> largest atomic distance between images is     0.3872417715     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10182E-03 d,cutoff=     3.3313         3.3508     max grad=    0.75251E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133177442        0.1132538806E-01
 intlbfgs> Highest QCI image energy=    0.1096918343E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1096918343E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    250   -0.1000000000+201    0.1018236828E-03   -0.1000000000+201    0.7525133892E-02    0.5376599294E-06        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3872417436     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10182E-03 d,cutoff=     3.3313         3.3508     max grad=    0.75251E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133177458        0.1132617385E-01
 intlbfgs> Highest QCI image energy=    0.1096873946E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1096873946E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    251   -0.1000000000+201    0.1018208324E-03   -0.1000000000+201    0.7525083461E-02    0.9717138395E-06        15     3
 intlbfgs> largest atomic distance between images is     0.3872419699     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10168E-03 d,cutoff=     3.3313         3.3508     max grad=    0.75205E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133178064        0.1137331279E-01
 intlbfgs> Highest QCI image energy=    0.1095285587E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1095285587E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    252   -0.1000000000+201    0.1016848458E-03   -0.1000000000+201    0.7520519184E-02    0.1236637698E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872433820     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10145E-03 d,cutoff=     3.3314         3.3508     max grad=    0.75118E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133179032        0.1141999746E-01
 intlbfgs> Highest QCI image energy=    0.1092755941E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1092755941E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    253   -0.1000000000+201    0.1014490916E-03   -0.1000000000+201    0.7511824003E-02    0.1649614952E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872442974     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10137E-03 d,cutoff=     3.3314         3.3508     max grad=    0.75085E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133179329        0.1142064846E-01
 intlbfgs> Highest QCI image energy=    0.1091980712E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1091980712E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    254   -0.1000000000+201    0.1013692433E-03   -0.1000000000+201    0.7508540863E-02    0.7185800338E-05        15     3
 intlbfgs> Mean deviation     0.1142064846E-01 Decreasing QCI force constant to      1.806055915    
 intlbfgs> largest atomic distance between images is     0.3872445521     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10136E-03 d,cutoff=     3.3314         3.3508     max grad=    0.75082E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133179330        0.1141357006E-01
 intlbfgs> Highest QCI image energy=    0.1091978021E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1091978021E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    255   -0.1000000000+201    0.1013649650E-03   -0.1000000000+201    0.7508207904E-02    0.2650982075E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3872850690     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10032E-03 d,cutoff=     3.3315         3.3508     max grad=    0.74433E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133182305        0.1043968987E-01
 intlbfgs> Highest QCI image energy=    0.1087858134E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1087858134E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    256   -0.1000000000+201    0.1003161564E-03   -0.1000000000+201    0.7443278251E-02    0.3968426874E-03        15     3
 intlbfgs> largest atomic distance between images is     0.3872448443     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10136E-03 d,cutoff=     3.3314         3.3508     max grad=    0.75077E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133179354        0.1140726329E-01
 intlbfgs> Highest QCI image energy=    0.1091915766E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1091915766E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    257   -0.1000000000+201    0.1013552229E-03   -0.1000000000+201    0.7507671607E-02    0.3941428546E-03        15     3
 intlbfgs> largest atomic distance between images is     0.3872448573     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10135E-03 d,cutoff=     3.3314         3.3508     max grad=    0.75076E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133179365        0.1140787873E-01
 intlbfgs> Highest QCI image energy=    0.1091886668E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1091886668E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    258   -0.1000000000+201    0.1013525683E-03   -0.1000000000+201    0.7507576272E-02    0.1921612939E-06        15     3
 intlbfgs> largest atomic distance between images is     0.3872473474     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10091E-03 d,cutoff=     3.3314         3.3508     max grad=    0.74913E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133181238        0.1150120064E-01
 intlbfgs> Highest QCI image energy=    0.1087033883E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1087033883E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    259   -0.1000000000+201    0.1009063722E-03   -0.1000000000+201    0.7491257001E-02    0.3171542516E-04        15     3
 intlbfgs> Mean deviation     0.1150120064E-01 Decreasing QCI force constant to      1.788174173    
 intlbfgs> largest atomic distance between images is     0.3872473551     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10091E-03 d,cutoff=     3.3314         3.3508     max grad=    0.74912E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133181241        0.1150139463E-01
 intlbfgs> Highest QCI image energy=    0.1087027943E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1087027943E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    260   -0.1000000000+201    0.1009054993E-03   -0.1000000000+201    0.7491217011E-02    0.4566307386E-06        15     3
 intlbfgs> largest atomic distance between images is     0.3872482339     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10083E-03 d,cutoff=     3.3314         3.3508     max grad=    0.74872E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133181342        0.1151982294E-01
 intlbfgs> Highest QCI image energy=    0.1086895346E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1086895346E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    261   -0.1000000000+201    0.1008341513E-03   -0.1000000000+201    0.7487171368E-02    0.8309035283E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872473580     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10091E-03 d,cutoff=     3.3314         3.3508     max grad=    0.74912E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133181239        0.1150140642E-01
 intlbfgs> Highest QCI image energy=    0.1087032038E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1087032038E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    262   -0.1000000000+201    0.1009055509E-03   -0.1000000000+201    0.7491208052E-02    0.8252154824E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3872473608     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10091E-03 d,cutoff=     3.3314         3.3508     max grad=    0.74912E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133181241        0.1150147070E-01
 intlbfgs> Highest QCI image energy=    0.1087027039E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1087027039E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    263   -0.1000000000+201    0.1009051260E-03   -0.1000000000+201    0.7491191978E-02    0.3727485740E-07        15     3
 intlbfgs> largest atomic distance between images is     0.3872500403     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10047E-03 d,cutoff=     3.3314         3.3508     max grad=    0.74749E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133183102        0.1158516077E-01
 intlbfgs> Highest QCI image energy=    0.1082253559E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1082253559E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    264   -0.1000000000+201    0.1004662180E-03   -0.1000000000+201    0.7474928695E-02    0.3135336857E-04        15     3
 intlbfgs> Mean deviation     0.1158516077E-01 Decreasing QCI force constant to      1.770469478    
 intlbfgs> largest atomic distance between images is     0.3872501694     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10044E-03 d,cutoff=     3.3314         3.3508     max grad=    0.74741E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133183178        0.1159027662E-01
 intlbfgs> Highest QCI image energy=    0.1082059758E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1082059758E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    265   -0.1000000000+201    0.1004441138E-03   -0.1000000000+201    0.7474118102E-02    0.3069543990E-05        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3872500586     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10046E-03 d,cutoff=     3.3314         3.3508     max grad=    0.74749E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133183187        0.1158181606E-01
 intlbfgs> Highest QCI image energy=    0.1082042100E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1082042100E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    266   -0.1000000000+201    0.1004648871E-03   -0.1000000000+201    0.7474883953E-02    0.1647998885E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872501830     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10044E-03 d,cutoff=     3.3314         3.3508     max grad=    0.74740E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133183189        0.1159181679E-01
 intlbfgs> Highest QCI image energy=    0.1082030485E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1082030485E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    267   -0.1000000000+201    0.1004388434E-03   -0.1000000000+201    0.7473993798E-02    0.1610594078E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872502106     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10044E-03 d,cutoff=     3.3314         3.3508     max grad=    0.74739E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133183199        0.1159185441E-01
 intlbfgs> Highest QCI image energy=    0.1082006447E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1082006447E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    268   -0.1000000000+201    0.1004365604E-03   -0.1000000000+201    0.7473887243E-02    0.4866996524E-06        15     3
 intlbfgs> largest atomic distance between images is     0.3872512287     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.10031E-03 d,cutoff=     3.3315         3.3508     max grad=    0.74688E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133183716        0.1161100864E-01
 intlbfgs> Highest QCI image energy=    0.1080690713E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1080690713E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    269   -0.1000000000+201    0.1003080145E-03   -0.1000000000+201    0.7468762600E-02    0.1362843812E-04        15     3
 intlbfgs> Mean deviation     0.1161100864E-01 Decreasing QCI force constant to      1.752940078    
 intlbfgs> largest atomic distance between images is     0.3872530734     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.99957E-04 d,cutoff=     3.3315         3.3508     max grad=    0.74562E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133185244        0.1168494541E-01
 intlbfgs> Highest QCI image energy=    0.1076814368E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1076814368E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    270   -0.1000000000+201    0.9995718337E-04   -0.1000000000+201    0.7456157921E-02    0.2809285195E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872719242     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.95899E-04 d,cutoff=     3.3319         3.3508     max grad=    0.73130E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133204995        0.1261450770E-01
 intlbfgs> Highest QCI image energy=    0.1030817067E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1030817067E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    271   -0.1000000000+201    0.9589908575E-04   -0.1000000000+201    0.7313045009E-02    0.4286198745E-03        15     3
 intlbfgs> largest atomic distance between images is     0.3872531195     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.99841E-04 d,cutoff=     3.3315         3.3508     max grad=    0.74527E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133185836        0.1172062489E-01
 intlbfgs> Highest QCI image energy=    0.1075336276E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1075336276E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    272   -0.1000000000+201    0.9984055429E-04   -0.1000000000+201    0.7452735267E-02    0.4043990843E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3872544166     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.99696E-04 d,cutoff=     3.3315         3.3508     max grad=    0.74468E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133186407        0.1173988957E-01
 intlbfgs> Highest QCI image energy=    0.1073889914E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1073889914E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    273   -0.1000000000+201    0.9969560261E-04   -0.1000000000+201    0.7446786832E-02    0.1712688822E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872558639     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.99518E-04 d,cutoff=     3.3315         3.3508     max grad=    0.74396E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133187126        0.1176902895E-01
 intlbfgs> Highest QCI image energy=    0.1072082679E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1072082679E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    274   -0.1000000000+201    0.9951771308E-04   -0.1000000000+201    0.7439645815E-02    0.1751599395E-04        15     3
 intlbfgs> Mean deviation     0.1176902895E-01 Decreasing QCI force constant to      1.735584235    
 intlbfgs> largest atomic distance between images is     0.3872558609     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.99518E-04 d,cutoff=     3.3315         3.3508     max grad=    0.74397E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133187128        0.1176878235E-01
 intlbfgs> Highest QCI image energy=    0.1072079382E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1072079382E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    275   -0.1000000000+201    0.9951766871E-04   -0.1000000000+201    0.7439650099E-02    0.2180261305E-06        15     3
 intlbfgs> largest atomic distance between images is     0.3872553487     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.99543E-04 d,cutoff=     3.3315         3.3508     max grad=    0.74412E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133187141        0.1173683474E-01
 intlbfgs> Highest QCI image energy=    0.1072060985E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1072060985E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    276   -0.1000000000+201    0.9954324691E-04   -0.1000000000+201    0.7441240737E-02    0.2309288169E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872558559     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.99518E-04 d,cutoff=     3.3315         3.3508     max grad=    0.74397E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133187127        0.1176851542E-01
 intlbfgs> Highest QCI image energy=    0.1072081882E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1072081882E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    277   -0.1000000000+201    0.9951811517E-04   -0.1000000000+201    0.7439671269E-02    0.2294454816E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3872558579     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.99518E-04 d,cutoff=     3.3315         3.3508     max grad=    0.74397E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133187128        0.1176859980E-01
 intlbfgs> Highest QCI image energy=    0.1072079247E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1072079247E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    278   -0.1000000000+201    0.9951783845E-04   -0.1000000000+201    0.7439660122E-02    0.2991766432E-07        15     3
 intlbfgs> largest atomic distance between images is     0.3872575669     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.99258E-04 d,cutoff=     3.3316         3.3508     max grad=    0.74296E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133188191        0.1183273153E-01
 intlbfgs> Highest QCI image energy=    0.1069429051E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1069429051E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    279   -0.1000000000+201    0.9925828299E-04   -0.1000000000+201    0.7429621303E-02    0.2043613633E-04        15     3
 intlbfgs> Mean deviation     0.1183273153E-01 Decreasing QCI force constant to      1.718400233    
 intlbfgs> largest atomic distance between images is     0.3872586807     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.99055E-04 d,cutoff=     3.3316         3.3508     max grad=    0.74224E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133189128        0.1185991271E-01
 intlbfgs> Highest QCI image energy=    0.1067099942E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1067099942E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    280   -0.1000000000+201    0.9905486141E-04   -0.1000000000+201    0.7422380251E-02    0.1800081006E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3872600915     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.98897E-04 d,cutoff=     3.3316         3.3508     max grad=    0.74153E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133189632        0.1193520930E-01
 intlbfgs> Highest QCI image energy=    0.1065881226E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1065881226E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    281   -0.1000000000+201    0.9889665346E-04   -0.1000000000+201    0.7415334065E-02    0.3463732984E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872606802     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.98725E-04 d,cutoff=     3.3316         3.3508     max grad=    0.74101E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133190558        0.1192924675E-01
 intlbfgs> Highest QCI image energy=    0.1063569551E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1063569551E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    282   -0.1000000000+201    0.9872453480E-04   -0.1000000000+201    0.7410118537E-02    0.3540219449E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872613914     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.98617E-04 d,cutoff=     3.3316         3.3508     max grad=    0.74061E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133191049        0.1194369966E-01
 intlbfgs> Highest QCI image energy=    0.1062363294E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1062363294E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    283   -0.1000000000+201    0.9861659808E-04   -0.1000000000+201    0.7406058016E-02    0.8580018104E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3872616218     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.98585E-04 d,cutoff=     3.3316         3.3508     max grad=    0.74048E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133191183        0.1194924968E-01
 intlbfgs> Highest QCI image energy=    0.1062034934E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1062034934E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    284   -0.1000000000+201    0.9858525995E-04   -0.1000000000+201    0.7404808669E-02    0.3203696056E-05        15     3
 intlbfgs> Mean deviation     0.1194924968E-01 Decreasing QCI force constant to      1.701386369    
 intlbfgs> largest atomic distance between images is     0.3872616179     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.98585E-04 d,cutoff=     3.3316         3.3508     max grad=    0.74048E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133191181        0.1194955611E-01
 intlbfgs> Highest QCI image energy=    0.1062039167E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1062039167E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    285   -0.1000000000+201    0.9858542013E-04   -0.1000000000+201    0.7404808676E-02    0.4744714728E-06        15     3
 intlbfgs> largest atomic distance between images is     0.3872615427     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.98550E-04 d,cutoff=     3.3316         3.3508     max grad=    0.74027E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133191244        0.1199280846E-01
 intlbfgs> Highest QCI image energy=    0.1061941218E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1061941218E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    286   -0.1000000000+201    0.9855007821E-04   -0.1000000000+201    0.7402737433E-02    0.5667848910E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872616219     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.98585E-04 d,cutoff=     3.3316         3.3508     max grad=    0.74048E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133191184        0.1194978628E-01
 intlbfgs> Highest QCI image energy=    0.1062032925E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1062032925E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    287   -0.1000000000+201    0.9858475052E-04   -0.1000000000+201    0.7404774778E-02    0.5614838844E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872616253     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.98584E-04 d,cutoff=     3.3316         3.3508     max grad=    0.74048E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133191186        0.1194999528E-01
 intlbfgs> Highest QCI image energy=    0.1062027661E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1062027661E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    288   -0.1000000000+201    0.9858416517E-04   -0.1000000000+201    0.7404753383E-02    0.7584344431E-07        15     3
 intlbfgs> largest atomic distance between images is     0.3872628673     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.98381E-04 d,cutoff=     3.3316         3.3508     max grad=    0.73972E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133192021        0.1200220060E-01
 intlbfgs> Highest QCI image energy=    0.1059986700E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1059986700E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    289   -0.1000000000+201    0.9838113845E-04   -0.1000000000+201    0.7397218821E-02    0.1714275632E-04        15     3
 intlbfgs> Mean deviation     0.1200220060E-01 Decreasing QCI force constant to      1.684540960    
 intlbfgs> largest atomic distance between images is     0.3872645169     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.98113E-04 d,cutoff=     3.3317         3.3508     max grad=    0.73871E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133193273        0.1204109637E-01
 intlbfgs> Highest QCI image energy=    0.1056935274E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1056935274E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    290   -0.1000000000+201    0.9811265636E-04   -0.1000000000+201    0.7387116936E-02    0.2266968013E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3872664390     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.97786E-04 d,cutoff=     3.3317         3.3508     max grad=    0.73752E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133194530        0.1214885651E-01
 intlbfgs> Highest QCI image energy=    0.1053922088E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1053922088E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    291   -0.1000000000+201    0.9778638243E-04   -0.1000000000+201    0.7375225806E-02    0.4290241938E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872698409     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.97213E-04 d,cutoff=     3.3318         3.3508     max grad=    0.73537E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133197464        0.1218768701E-01
 intlbfgs> Highest QCI image energy=    0.1046872585E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1046872585E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    292   -0.1000000000+201    0.9721263779E-04   -0.1000000000+201    0.7353680827E-02    0.7150109003E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872672315     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.97686E-04 d,cutoff=     3.3317         3.3508     max grad=    0.73710E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133195185        0.1212134938E-01
 intlbfgs> Highest QCI image energy=    0.1052315114E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1052315114E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    293   -0.1000000000+201    0.9768552878E-04   -0.1000000000+201    0.7370984397E-02    0.4108589556E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872674323     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.97649E-04 d,cutoff=     3.3317         3.3508     max grad=    0.73697E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133195335        0.1213166710E-01
 intlbfgs> Highest QCI image energy=    0.1051954621E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1051954621E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    294   -0.1000000000+201    0.9764930933E-04   -0.1000000000+201    0.7369669481E-02    0.3484669093E-05        15     3
 intlbfgs> Mean deviation     0.1213166710E-01 Decreasing QCI force constant to      1.667862336    
 intlbfgs> largest atomic distance between images is     0.3872674368     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.97649E-04 d,cutoff=     3.3317         3.3508     max grad=    0.73696E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133195336        0.1213195644E-01
 intlbfgs> Highest QCI image energy=    0.1051950551E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1051950551E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    295   -0.1000000000+201    0.9764877552E-04   -0.1000000000+201    0.7369636806E-02    0.6880231486E-06        15     3
 intlbfgs> largest atomic distance between images is     0.3872718664     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.97239E-04 d,cutoff=     3.3318         3.3508     max grad=    0.73372E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133202154        0.1245497422E-01
 intlbfgs> Highest QCI image energy=    0.1049974966E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1049974966E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    296   -0.1000000000+201    0.9723870957E-04   -0.1000000000+201    0.7337169697E-02    0.9185944321E-03        15     3
 intlbfgs> largest atomic distance between images is     0.3872674361     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.97649E-04 d,cutoff=     3.3317         3.3508     max grad=    0.73696E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133195336        0.1213236103E-01
 intlbfgs> Highest QCI image energy=    0.1051951219E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1051951219E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    297   -0.1000000000+201    0.9764864516E-04   -0.1000000000+201    0.7369619788E-02    0.9178472656E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3872674370     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.97648E-04 d,cutoff=     3.3317         3.3508     max grad=    0.73696E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133195337        0.1213240678E-01
 intlbfgs> Highest QCI image energy=    0.1051948784E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1051948784E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    298   -0.1000000000+201    0.9764843036E-04   -0.1000000000+201    0.7369612046E-02    0.1751461810E-07        15     3
 intlbfgs> largest atomic distance between images is     0.3872700900     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.97190E-04 d,cutoff=     3.3318         3.3508     max grad=    0.73525E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133197407        0.1222830721E-01
 intlbfgs> Highest QCI image energy=    0.1046995864E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1046995864E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    299   -0.1000000000+201    0.9719044030E-04   -0.1000000000+201    0.7352509448E-02    0.3298440212E-04        15     3
 intlbfgs> Mean deviation     0.1222830721E-01 Decreasing QCI force constant to      1.651348848    
 intlbfgs> largest atomic distance between images is     0.3872703444     for atom     10 and images      1     2 total images=     1
 checkrep> number of active repulsions and total=      69      69
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.97178E-04 d,cutoff=     3.3318         3.3508     max grad=    0.73519E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133197454        0.1222524490E-01
 intlbfgs> Highest QCI image energy=    0.1046884526E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1046884526E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    300   -0.1000000000+201    0.9717844347E-04   -0.1000000000+201    0.7351926063E-02    0.2237313542E-05        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.3872725219     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.97151E-04 d,cutoff=     3.3318         3.3508     max grad=    0.73494E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133197496        0.1217023583E-01
 intlbfgs> Highest QCI image energy=    0.1046797456E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1046797456E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    301   -0.1000000000+201    0.9715136365E-04   -0.1000000000+201    0.7349437009E-02    0.2354579729E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872704312     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.97182E-04 d,cutoff=     3.3318         3.3508     max grad=    0.73520E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133197436        0.1222108843E-01
 intlbfgs> Highest QCI image energy=    0.1046926574E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1046926574E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    302   -0.1000000000+201    0.9718159022E-04   -0.1000000000+201    0.7351970871E-02    0.2235502781E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3872704087     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.97178E-04 d,cutoff=     3.3318         3.3508     max grad=    0.73519E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133197454        0.1222298593E-01
 intlbfgs> Highest QCI image energy=    0.1046883869E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1046883869E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    303   -0.1000000000+201    0.9717813417E-04   -0.1000000000+201    0.7351873222E-02    0.5997982724E-06        15     3
 intlbfgs> largest atomic distance between images is     0.3872706976     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.96980E-04 d,cutoff=     3.3318         3.3508     max grad=    0.73451E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133198399        0.1228873479E-01
 intlbfgs> Highest QCI image energy=    0.1044640963E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1044640963E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    304   -0.1000000000+201    0.9698013513E-04   -0.1000000000+201    0.7345096399E-02    0.1860646272E-04        15     3
 intlbfgs> Mean deviation     0.1228873479E-01 Decreasing QCI force constant to      1.634998859    
 intlbfgs> largest atomic distance between images is     0.3872733387     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.96706E-04 d,cutoff=     3.3318         3.3508     max grad=    0.73341E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133199603        0.1231579879E-01
 intlbfgs> Highest QCI image energy=    0.1041795521E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1041795521E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    305   -0.1000000000+201    0.9670554181E-04   -0.1000000000+201    0.7334052478E-02    0.2209592976E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3872720409     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.96455E-04 d,cutoff=     3.3318         3.3508     max grad=    0.73267E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133200888        0.1244721756E-01
 intlbfgs> Highest QCI image energy=    0.1038796678E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1038796678E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    306   -0.1000000000+201    0.9645544170E-04   -0.1000000000+201    0.7326710832E-02    0.3913787723E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872791646     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.95936E-04 d,cutoff=     3.3319         3.3508     max grad=    0.73042E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133203064        0.1243899982E-01
 intlbfgs> Highest QCI image energy=    0.1033705876E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1033705876E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    307   -0.1000000000+201    0.9593604185E-04   -0.1000000000+201    0.7304241753E-02    0.5830105215E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872763042     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.96244E-04 d,cutoff=     3.3319         3.3508     max grad=    0.73165E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133201725        0.1240465684E-01
 intlbfgs> Highest QCI image energy=    0.1036817368E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1036817368E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    308   -0.1000000000+201    0.9624442091E-04   -0.1000000000+201    0.7316508954E-02    0.2447458940E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872762847     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.96233E-04 d,cutoff=     3.3319         3.3508     max grad=    0.73162E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133201774        0.1241034407E-01
 intlbfgs> Highest QCI image energy=    0.1036702755E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1036702755E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    309   -0.1000000000+201    0.9623283315E-04   -0.1000000000+201    0.7316154036E-02    0.1196900260E-05        15     3
 intlbfgs> Mean deviation     0.1241034407E-01 Decreasing QCI force constant to      1.618810752    
 intlbfgs> largest atomic distance between images is     0.3872762942     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.96234E-04 d,cutoff=     3.3319         3.3508     max grad=    0.73162E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133201772        0.1240961600E-01
 intlbfgs> Highest QCI image energy=    0.1036708377E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1036708377E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    310   -0.1000000000+201    0.9623351328E-04   -0.1000000000+201    0.7316168430E-02    0.1592507833E-06        15     3
 intlbfgs> largest atomic distance between images is     0.3872764480     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.96234E-04 d,cutoff=     3.3319         3.3508     max grad=    0.73161E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133201775        0.1240288957E-01
 intlbfgs> Highest QCI image energy=    0.1036701694E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1036701694E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    311   -0.1000000000+201    0.9623415951E-04   -0.1000000000+201    0.7316067199E-02    0.1728960058E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3872764732     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.96225E-04 d,cutoff=     3.3319         3.3508     max grad=    0.73158E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133201795        0.1240772958E-01
 intlbfgs> Highest QCI image energy=    0.1036654071E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1036654071E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    312   -0.1000000000+201    0.9622483492E-04   -0.1000000000+201    0.7315779407E-02    0.1704907473E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3872765786     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.96185E-04 d,cutoff=     3.3319         3.3508     max grad=    0.73145E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133201923        0.1242503495E-01
 intlbfgs> Highest QCI image energy=    0.1036357482E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1036357482E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    313   -0.1000000000+201    0.9618463391E-04   -0.1000000000+201    0.7314478801E-02    0.4756585404E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3872769738     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.96091E-04 d,cutoff=     3.3319         3.3508     max grad=    0.73112E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133202281        0.1245546090E-01
 intlbfgs> Highest QCI image energy=    0.1035524944E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1035524944E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    314   -0.1000000000+201    0.9609124823E-04   -0.1000000000+201    0.7311223117E-02    0.7880028196E-05        15     3
 intlbfgs> Mean deviation     0.1245546090E-01 Decreasing QCI force constant to      1.602782922    
 intlbfgs> largest atomic distance between images is     0.3872791788     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.95767E-04 d,cutoff=     3.3319         3.3508     max grad=    0.72986E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133203919        0.1250237209E-01
 intlbfgs> Highest QCI image energy=    0.1031722596E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1031722596E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    315   -0.1000000000+201    0.9576733480E-04   -0.1000000000+201    0.7298566418E-02    0.2720836586E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872820928     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.95805E-04 d,cutoff=     3.3319         3.3508     max grad=    0.72952E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133205059        0.1229596669E-01
 intlbfgs> Highest QCI image energy=    0.1029305498E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1029305498E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    316   -0.1000000000+201    0.9580546222E-04   -0.1000000000+201    0.7295218902E-02    0.9316541575E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872795479     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.95462E-04 d,cutoff=     3.3319         3.3508     max grad=    0.72884E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133205371        0.1259701540E-01
 intlbfgs> Highest QCI image energy=    0.1028384328E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1028384328E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    317   -0.1000000000+201    0.9546243574E-04   -0.1000000000+201    0.7288412229E-02    0.9200832896E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872803183     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.95472E-04 d,cutoff=     3.3319         3.3508     max grad=    0.72879E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133205328        0.1257881884E-01
 intlbfgs> Highest QCI image energy=    0.1028477453E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1028477453E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    318   -0.1000000000+201    0.9547244178E-04   -0.1000000000+201    0.7287906268E-02    0.9482941076E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3872828571     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.95207E-04 d,cutoff=     3.3320         3.3508     max grad=    0.72769E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133206589        0.1261142121E-01
 intlbfgs> Highest QCI image energy=    0.1025589769E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1025589769E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    319   -0.1000000000+201    0.9520671715E-04   -0.1000000000+201    0.7276918480E-02    0.2170209068E-04        15     3
 intlbfgs> Mean deviation     0.1261142121E-01 Decreasing QCI force constant to      1.586913785    
 intlbfgs> largest atomic distance between images is     0.3872822785     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.95284E-04 d,cutoff=     3.3319         3.3508     max grad=    0.72801E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133206197        0.1259725607E-01
 intlbfgs> Highest QCI image energy=    0.1026485456E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1026485456E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    320   -0.1000000000+201    0.9528410522E-04   -0.1000000000+201    0.7280088363E-02    0.6317286432E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3872827210     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.95216E-04 d,cutoff=     3.3320         3.3508     max grad=    0.72774E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133206527        0.1261148826E-01
 intlbfgs> Highest QCI image energy=    0.1025729835E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1025729835E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    321   -0.1000000000+201    0.9521621189E-04   -0.1000000000+201    0.7277414646E-02    0.5205960674E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3872852776     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.94805E-04 d,cutoff=     3.3320         3.3508     max grad=    0.72619E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133208457        0.1269373352E-01
 intlbfgs> Highest QCI image energy=    0.1021340280E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1021340280E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    322   -0.1000000000+201    0.9480473846E-04   -0.1000000000+201    0.7261861827E-02    0.2957817432E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872853058     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.94808E-04 d,cutoff=     3.3320         3.3508     max grad=    0.72619E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133208452        0.1269124618E-01
 intlbfgs> Highest QCI image energy=    0.1021353491E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1021353491E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    323   -0.1000000000+201    0.9480805335E-04   -0.1000000000+201    0.7261903251E-02    0.6596739395E-06        15     3
 intlbfgs> largest atomic distance between images is     0.3872853030     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.94808E-04 d,cutoff=     3.3320         3.3508     max grad=    0.72619E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133208451        0.1269137944E-01
 intlbfgs> Highest QCI image energy=    0.1021354102E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1021354102E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    324   -0.1000000000+201    0.9480780719E-04   -0.1000000000+201    0.7261903940E-02    0.8565794945E-07        15     3
 intlbfgs> Mean deviation     0.1269137944E-01 Decreasing QCI force constant to      1.571201767    
 intlbfgs> largest atomic distance between images is     0.3872853035     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.94808E-04 d,cutoff=     3.3320         3.3508     max grad=    0.72619E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133208451        0.1269134843E-01
 intlbfgs> Highest QCI image energy=    0.1021354069E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1021354069E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    325   -0.1000000000+201    0.9480779188E-04   -0.1000000000+201    0.7261903508E-02    0.1061799256E-07        15     3
 intlbfgs> largest atomic distance between images is     0.3872862650     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.94780E-04 d,cutoff=     3.3320         3.3508     max grad=    0.72612E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133208456        0.1262051579E-01
 intlbfgs> Highest QCI image energy=    0.1021353577E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1021353577E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    326   -0.1000000000+201    0.9478031189E-04   -0.1000000000+201    0.7261197586E-02    0.2379662399E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872853041     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.94808E-04 d,cutoff=     3.3320         3.3508     max grad=    0.72619E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133208451        0.1269130536E-01
 intlbfgs> Highest QCI image energy=    0.1021354100E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1021354100E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    327   -0.1000000000+201    0.9480778498E-04   -0.1000000000+201    0.7261903254E-02    0.2378286899E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3872853041     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.94808E-04 d,cutoff=     3.3320         3.3508     max grad=    0.72619E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133208451        0.1269130809E-01
 intlbfgs> Highest QCI image energy=    0.1021354068E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1021354068E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    328   -0.1000000000+201    0.9480778228E-04   -0.1000000000+201    0.7261903157E-02    0.5018682534E-09        15     3
 intlbfgs> largest atomic distance between images is     0.3872858828     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.94633E-04 d,cutoff=     3.3320         3.3508     max grad=    0.72553E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133209339        0.1278406379E-01
 intlbfgs> Highest QCI image energy=    0.1019348556E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1019348556E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    329   -0.1000000000+201    0.9463270300E-04   -0.1000000000+201    0.7255285761E-02    0.1847084686E-04        15     3
 intlbfgs> Mean deviation     0.1278406379E-01 Decreasing QCI force constant to      1.555645314    
 intlbfgs> largest atomic distance between images is     0.3872884493     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.94318E-04 d,cutoff=     3.3320         3.3508     max grad=    0.72432E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133210793        0.1278296149E-01
 intlbfgs> Highest QCI image energy=    0.1016077012E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1016077012E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    330   -0.1000000000+201    0.9431826838E-04   -0.1000000000+201    0.7243182657E-02    0.2589211130E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872974685     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.93651E-04 d,cutoff=     3.3321         3.3508     max grad=    0.72172E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133213615        0.1240316927E-01
 intlbfgs> Highest QCI image energy=    0.1010021064E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1010021064E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    331   -0.1000000000+201    0.9365098172E-04   -0.1000000000+201    0.7217236907E-02    0.1214197048E-03        15     3
 intlbfgs> largest atomic distance between images is     0.3872889736     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.94321E-04 d,cutoff=     3.3320         3.3508     max grad=    0.72431E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133210766        0.1270405134E-01
 intlbfgs> Highest QCI image energy=    0.1016145817E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1016145817E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    332   -0.1000000000+201    0.9432149174E-04   -0.1000000000+201    0.7243136097E-02    0.1090013393E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3872892158     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.94245E-04 d,cutoff=     3.3321         3.3508     max grad=    0.72402E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133211183        0.1274903231E-01
 intlbfgs> Highest QCI image energy=    0.1015209208E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1015209208E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    333   -0.1000000000+201    0.9424456096E-04   -0.1000000000+201    0.7240174044E-02    0.9121536257E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3872911335     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.93875E-04 d,cutoff=     3.3321         3.3508     max grad=    0.72262E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133212933        0.1288908198E-01
 intlbfgs> Highest QCI image energy=    0.1011302722E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1011302722E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    334   -0.1000000000+201    0.9387462269E-04   -0.1000000000+201    0.7226200372E-02    0.3007857437E-04        15     3
 intlbfgs> Mean deviation     0.1288908198E-01 Decreasing QCI force constant to      1.540242885    
 intlbfgs> largest atomic distance between images is     0.3872913947     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.93851E-04 d,cutoff=     3.3321         3.3508     max grad=    0.72253E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133213047        0.1288154201E-01
 intlbfgs> Highest QCI image energy=    0.1011049491E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1011049491E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    335   -0.1000000000+201    0.9385149695E-04   -0.1000000000+201    0.7225273716E-02    0.2935621094E-05        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3872913091     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.93831E-04 d,cutoff=     3.3321         3.3508     max grad=    0.72246E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133213144        0.1291133730E-01
 intlbfgs> Highest QCI image energy=    0.1010832744E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1010832744E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    336   -0.1000000000+201    0.9383102039E-04   -0.1000000000+201    0.7224557355E-02    0.5354570523E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3872923403     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.93675E-04 d,cutoff=     3.3321         3.3508     max grad=    0.72186E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133213909        0.1295040160E-01
 intlbfgs> Highest QCI image energy=    0.1009138810E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1009138810E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    337   -0.1000000000+201    0.9367519476E-04   -0.1000000000+201    0.7218551369E-02    0.1201202890E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872944215     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.93382E-04 d,cutoff=     3.3321         3.3508     max grad=    0.72072E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133215334        0.1298327154E-01
 intlbfgs> Highest QCI image energy=    0.1005996824E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1005996824E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    338   -0.1000000000+201    0.9338218666E-04   -0.1000000000+201    0.7207205234E-02    0.2189830431E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872944788     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.93371E-04 d,cutoff=     3.3321         3.3508     max grad=    0.72068E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133215387        0.1297864082E-01
 intlbfgs> Highest QCI image energy=    0.1005879803E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1005879803E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    339   -0.1000000000+201    0.9337106530E-04   -0.1000000000+201    0.7206797078E-02    0.2416431752E-05        15     3
 intlbfgs> Mean deviation     0.1297864082E-01 Decreasing QCI force constant to      1.524992955    
 intlbfgs> largest atomic distance between images is     0.3872944654     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.93372E-04 d,cutoff=     3.3321         3.3508     max grad=    0.72068E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133215382        0.1297725880E-01
 intlbfgs> Highest QCI image energy=    0.1005891442E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1005891442E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    340   -0.1000000000+201    0.9337195932E-04   -0.1000000000+201    0.7206837102E-02    0.5120313517E-06        15     3
 intlbfgs> largest atomic distance between images is     0.3872943407     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.93364E-04 d,cutoff=     3.3321         3.3508     max grad=    0.72067E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133215400        0.1294655480E-01
 intlbfgs> Highest QCI image energy=    0.1005855713E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1005855713E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    341   -0.1000000000+201    0.9336394281E-04   -0.1000000000+201    0.7206663784E-02    0.1293765248E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872944798     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.93370E-04 d,cutoff=     3.3321         3.3508     max grad=    0.72068E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133215392        0.1297503264E-01
 intlbfgs> Highest QCI image energy=    0.1005869052E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1005869052E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    342   -0.1000000000+201    0.9336984823E-04   -0.1000000000+201    0.7206758273E-02    0.1220280422E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3872945020     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.93368E-04 d,cutoff=     3.3321         3.3508     max grad=    0.72067E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133215401        0.1297635267E-01
 intlbfgs> Highest QCI image energy=    0.1005848304E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1005848304E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    343   -0.1000000000+201    0.9336795199E-04   -0.1000000000+201    0.7206678476E-02    0.4681724129E-06        15     3
 intlbfgs> largest atomic distance between images is     0.3872953330     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.93275E-04 d,cutoff=     3.3321         3.3508     max grad=    0.72030E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133215864        0.1301521458E-01
 intlbfgs> Highest QCI image energy=    0.1004833679E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1004833679E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    344   -0.1000000000+201    0.9327505523E-04   -0.1000000000+201    0.7202953356E-02    0.1223961640E-04        15     3
 intlbfgs> Mean deviation     0.1301521458E-01 Decreasing QCI force constant to      1.509894015    
 intlbfgs> largest atomic distance between images is     0.3872976317     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.92873E-04 d,cutoff=     3.3322         3.3508     max grad=    0.71877E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133217842        0.1307471309E-01
 intlbfgs> Highest QCI image energy=    0.1000511498E-03 images=       1
 intlbfgs> Highest image        2 energy     0.1000511498E-03 is      0.000000000     sigma from the mean
 intlbfgs> steps:    345   -0.1000000000+201    0.9287278043E-04   -0.1000000000+201    0.7187659259E-02    0.3112283861E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3873203883     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.88317E-04 d,cutoff=     3.3326         3.3508     max grad=    0.70143E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133241853        0.1339816358E-01
 intlbfgs> Highest QCI image energy=    0.9522665418E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9522665418E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    346   -0.1000000000+201    0.8831720307E-04   -0.1000000000+201    0.7014313604E-02    0.4426883923E-03        15     3
 intlbfgs> largest atomic distance between images is     0.3872976846     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.92737E-04 d,cutoff=     3.3322         3.3508     max grad=    0.71831E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133218516        0.1304710805E-01
 intlbfgs> Highest QCI image energy=    0.9990658478E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9990658478E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    347   -0.1000000000+201    0.9273677010E-04   -0.1000000000+201    0.7183065526E-02    0.4168826893E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3872995323     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.92543E-04 d,cutoff=     3.3322         3.3508     max grad=    0.71751E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133219475        0.1312699828E-01
 intlbfgs> Highest QCI image energy=    0.9969731658E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9969731658E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    348   -0.1000000000+201    0.9254337373E-04   -0.1000000000+201    0.7175108743E-02    0.2593374840E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3873006595     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.92410E-04 d,cutoff=     3.3322         3.3508     max grad=    0.71697E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133220143        0.1316999663E-01
 intlbfgs> Highest QCI image energy=    0.9955296622E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9955296622E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    349   -0.1000000000+201    0.9240981805E-04   -0.1000000000+201    0.7169692035E-02    0.1319894549E-04        15     3
 intlbfgs> Mean deviation     0.1316999663E-01 Decreasing QCI force constant to      1.494944570    
 intlbfgs> largest atomic distance between images is     0.3873006560     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.92409E-04 d,cutoff=     3.3322         3.3508     max grad=    0.71697E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133220144        0.1317022222E-01
 intlbfgs> Highest QCI image energy=    0.9955267748E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9955267748E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    350   -0.1000000000+201    0.9240948982E-04   -0.1000000000+201    0.7169687355E-02    0.8446239599E-07        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3873007453     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.92410E-04 d,cutoff=     3.3322         3.3508     max grad=    0.71696E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133220145        0.1316744407E-01
 intlbfgs> Highest QCI image energy=    0.9955243831E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9955243831E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    351   -0.1000000000+201    0.9241024259E-04   -0.1000000000+201    0.7169582345E-02    0.1378146362E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3873006886     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.92408E-04 d,cutoff=     3.3322         3.3508     max grad=    0.71696E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133220152        0.1316996790E-01
 intlbfgs> Highest QCI image energy=    0.9955099186E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9955099186E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    352   -0.1000000000+201    0.9240782640E-04   -0.1000000000+201    0.7169590229E-02    0.9865730401E-06        15     3
 intlbfgs> largest atomic distance between images is     0.3873005140     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.92391E-04 d,cutoff=     3.3322         3.3508     max grad=    0.71693E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133220215        0.1318121840E-01
 intlbfgs> Highest QCI image energy=    0.9953745809E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9953745809E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    353   -0.1000000000+201    0.9239117303E-04   -0.1000000000+201    0.7169335546E-02    0.3943487313E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3873004261     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.92357E-04 d,cutoff=     3.3322         3.3508     max grad=    0.71684E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133220366        0.1319695649E-01
 intlbfgs> Highest QCI image energy=    0.9950504503E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9950504503E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    354   -0.1000000000+201    0.9235668427E-04   -0.1000000000+201    0.7168429962E-02    0.4813352044E-05        15     3
 intlbfgs> Mean deviation     0.1319695649E-01 Decreasing QCI force constant to      1.480143138    
 intlbfgs> largest atomic distance between images is     0.3873036573     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.91940E-04 d,cutoff=     3.3323         3.3508     max grad=    0.71515E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133222503        0.1326392617E-01
 intlbfgs> Highest QCI image energy=    0.9904672090E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9904672090E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    355   -0.1000000000+201    0.9193977049E-04   -0.1000000000+201    0.7151532281E-02    0.3230028423E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3873140019     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.89673E-04 d,cutoff=     3.3325         3.3508     max grad=    0.70691E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133234044        0.1381712437E-01
 intlbfgs> Highest QCI image energy=    0.9664863687E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9664863687E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    356   -0.1000000000+201    0.8967266943E-04   -0.1000000000+201    0.7069127432E-02    0.1766881984E-03        15     3
 intlbfgs> largest atomic distance between images is     0.3873097063     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.91331E-04 d,cutoff=     3.3323         3.3508     max grad=    0.71250E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133225774        0.1332125298E-01
 intlbfgs> Highest QCI image energy=    0.9835508039E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9835508039E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    357   -0.1000000000+201    0.9133131792E-04   -0.1000000000+201    0.7124965365E-02    0.1491758411E-03        15     3
 intlbfgs> largest atomic distance between images is     0.3873007073     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.91865E-04 d,cutoff=     3.3323         3.3508     max grad=    0.71535E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133222573        0.1339370931E-01
 intlbfgs> Highest QCI image energy=    0.9903605812E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9903605812E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    358   -0.1000000000+201    0.9186480948E-04   -0.1000000000+201    0.7153475497E-02    0.8921449994E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3873069180     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.91441E-04 d,cutoff=     3.3323         3.3508     max grad=    0.71321E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133225032        0.1336608738E-01
 intlbfgs> Highest QCI image energy=    0.9850994356E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9850994356E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    359   -0.1000000000+201    0.9144111229E-04   -0.1000000000+201    0.7132113492E-02    0.5944213619E-04        15     3
 intlbfgs> Mean deviation     0.1336608738E-01 Decreasing QCI force constant to      1.465488256    
 intlbfgs> largest atomic distance between images is     0.3873069138     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.91443E-04 d,cutoff=     3.3323         3.3508     max grad=    0.71322E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133225022        0.1336503932E-01
 intlbfgs> Highest QCI image energy=    0.9851200264E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9851200264E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    360   -0.1000000000+201    0.9144314934E-04   -0.1000000000+201    0.7132187837E-02    0.2365956520E-06        15     3
 intlbfgs> largest atomic distance between images is     0.3873069358     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.91441E-04 d,cutoff=     3.3323         3.3508     max grad=    0.71321E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133225032        0.1336479482E-01
 intlbfgs> Highest QCI image energy=    0.9850994297E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9850994297E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    361   -0.1000000000+201    0.9144145666E-04   -0.1000000000+201    0.7132110438E-02    0.2213876114E-06        15     3
 intlbfgs> largest atomic distance between images is     0.3873102520     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.90973E-04 d,cutoff=     3.3324         3.3508     max grad=    0.71130E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133227480        0.1347081543E-01
 intlbfgs> Highest QCI image energy=    0.9799540376E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9799540376E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    362   -0.1000000000+201    0.9097281237E-04   -0.1000000000+201    0.7112950339E-02    0.3703419098E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3873102099     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.90958E-04 d,cutoff=     3.3324         3.3508     max grad=    0.71132E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133227526        0.1345220136E-01
 intlbfgs> Highest QCI image energy=    0.9798569345E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9798569345E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    363   -0.1000000000+201    0.9095796710E-04   -0.1000000000+201    0.7113181289E-02    0.1184779875E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3873100721     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.90960E-04 d,cutoff=     3.3324         3.3508     max grad=    0.71133E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133227498        0.1346195709E-01
 intlbfgs> Highest QCI image energy=    0.9799147716E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9799147716E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    364   -0.1000000000+201    0.9095993995E-04   -0.1000000000+201    0.7113348927E-02    0.2776154868E-05        15     3
 intlbfgs> Mean deviation     0.1346195709E-01 Decreasing QCI force constant to      1.450978471    
 intlbfgs> largest atomic distance between images is     0.3873100679     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.90958E-04 d,cutoff=     3.3324         3.3508     max grad=    0.71133E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133227505        0.1346317126E-01
 intlbfgs> Highest QCI image energy=    0.9799000339E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9799000339E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    365   -0.1000000000+201    0.9095837107E-04   -0.1000000000+201    0.7113304291E-02    0.3167444945E-06        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3873101712     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.90959E-04 d,cutoff=     3.3324         3.3508     max grad=    0.71132E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133227511        0.1345660088E-01
 intlbfgs> Highest QCI image energy=    0.9798874345E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9798874345E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    366   -0.1000000000+201    0.9095897885E-04   -0.1000000000+201    0.7113200237E-02    0.2099480760E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3873102601     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.90951E-04 d,cutoff=     3.3324         3.3508     max grad=    0.71128E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133227568        0.1345788406E-01
 intlbfgs> Highest QCI image energy=    0.9797688976E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9797688976E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    367   -0.1000000000+201    0.9095120686E-04   -0.1000000000+201    0.7112814788E-02    0.1441681710E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3873120772     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.90721E-04 d,cutoff=     3.3324         3.3508     max grad=    0.71032E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133228892        0.1350223297E-01
 intlbfgs> Highest QCI image energy=    0.9770096988E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9770096988E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    368   -0.1000000000+201    0.9072146656E-04   -0.1000000000+201    0.7103181991E-02    0.2177064736E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3873130410     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.90552E-04 d,cutoff=     3.3324         3.3508     max grad=    0.70968E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133229718        0.1354215236E-01
 intlbfgs> Highest QCI image energy=    0.9752935600E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9752935600E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    369   -0.1000000000+201    0.9055176710E-04   -0.1000000000+201    0.7096809188E-02    0.1231843597E-04        15     3
 intlbfgs> Mean deviation     0.1354215236E-01 Decreasing QCI force constant to      1.436612347    
 intlbfgs> largest atomic distance between images is     0.3873132423     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.90473E-04 d,cutoff=     3.3324         3.3508     max grad=    0.70943E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133230016        0.1356138854E-01
 intlbfgs> Highest QCI image energy=    0.9746739889E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9746739889E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    370   -0.1000000000+201    0.9047273832E-04   -0.1000000000+201    0.7094339656E-02    0.9022462607E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3873128944     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.90005E-04 d,cutoff=     3.3325         3.3508     max grad=    0.70828E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133231272        0.1368466399E-01
 intlbfgs> Highest QCI image energy=    0.9722339915E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9722339915E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    371   -0.1000000000+201    0.9000453747E-04   -0.1000000000+201    0.7082824160E-02    0.9108359311E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3873129992     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.90460E-04 d,cutoff=     3.3324         3.3508     max grad=    0.70945E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133229974        0.1356987052E-01
 intlbfgs> Highest QCI image energy=    0.9747623859E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9747623859E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    372   -0.1000000000+201    0.9046029794E-04   -0.1000000000+201    0.7094455024E-02    0.8434499209E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3873131944     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.90440E-04 d,cutoff=     3.3324         3.3508     max grad=    0.70936E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133230100        0.1357199419E-01
 intlbfgs> Highest QCI image energy=    0.9745011091E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9745011091E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    373   -0.1000000000+201    0.9044027364E-04   -0.1000000000+201    0.7093564243E-02    0.2239050337E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3873163647     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.90026E-04 d,cutoff=     3.3325         3.3508     max grad=    0.70766E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133232400        0.1364533008E-01
 intlbfgs> Highest QCI image energy=    0.9697607583E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9697607583E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    374   -0.1000000000+201    0.9002630424E-04   -0.1000000000+201    0.7076595058E-02    0.3377387389E-04        15     3
 intlbfgs> Mean deviation     0.1364533008E-01 Decreasing QCI force constant to      1.422388463    
 intlbfgs> largest atomic distance between images is     0.3873164464     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.89987E-04 d,cutoff=     3.3325         3.3508     max grad=    0.70753E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133232557        0.1365940918E-01
 intlbfgs> Highest QCI image energy=    0.9694385233E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9694385233E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    375   -0.1000000000+201    0.8998735746E-04   -0.1000000000+201    0.7075308467E-02    0.3602452876E-05        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3873168555     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.89985E-04 d,cutoff=     3.3325         3.3508     max grad=    0.70746E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133232684        0.1364818073E-01
 intlbfgs> Highest QCI image energy=    0.9691789685E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9691789685E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    376   -0.1000000000+201    0.8998507497E-04   -0.1000000000+201    0.7074621091E-02    0.6959206637E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3873175325     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.89862E-04 d,cutoff=     3.3325         3.3508     max grad=    0.70698E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133233316        0.1368677812E-01
 intlbfgs> Highest QCI image energy=    0.9678854895E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9678854895E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    377   -0.1000000000+201    0.8986200879E-04   -0.1000000000+201    0.7069808355E-02    0.1067430536E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3873192611     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.89544E-04 d,cutoff=     3.3325         3.3508     max grad=    0.70578E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133234914        0.1376197810E-01
 intlbfgs> Highest QCI image energy=    0.9646291925E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9646291925E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    378   -0.1000000000+201    0.8954441543E-04   -0.1000000000+201    0.7057791113E-02    0.2313877271E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3873195807     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.89501E-04 d,cutoff=     3.3325         3.3508     max grad=    0.70562E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133235127        0.1376431196E-01
 intlbfgs> Highest QCI image energy=    0.9641960522E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9641960522E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    379   -0.1000000000+201    0.8950075676E-04   -0.1000000000+201    0.7056174444E-02    0.5450932876E-05        15     3
 intlbfgs> Mean deviation     0.1376431196E-01 Decreasing QCI force constant to      1.408305409    
 intlbfgs> largest atomic distance between images is     0.3873196264     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.89499E-04 d,cutoff=     3.3325         3.3508     max grad=    0.70561E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133235133        0.1376029630E-01
 intlbfgs> Highest QCI image energy=    0.9641841144E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9641841144E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    380   -0.1000000000+201    0.8949873943E-04   -0.1000000000+201    0.7056141919E-02    0.2559531905E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3873962326     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.85483E-04 d,cutoff=     3.3329         3.3508     max grad=    0.69677E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133351772        0.8009735906E-02
 intlbfgs> Highest QCI image energy=    0.9394620106E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9394620106E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    381   -0.1000000000+201    0.8548327498E-04   -0.1000000000+201    0.6967652502E-02    0.3823936197E-02        15     3
 intlbfgs> largest atomic distance between images is     0.3873196894     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.89496E-04 d,cutoff=     3.3325         3.3508     max grad=    0.70561E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133235146        0.1375637872E-01
 intlbfgs> Highest QCI image energy=    0.9641575225E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9641575225E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    382   -0.1000000000+201    0.8949555098E-04   -0.1000000000+201    0.7056050249E-02    0.3821336618E-02        15     3
 intlbfgs> largest atomic distance between images is     0.3873196903     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.89495E-04 d,cutoff=     3.3325         3.3508     max grad=    0.70560E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133235149        0.1375660244E-01
 intlbfgs> Highest QCI image energy=    0.9641503518E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9641503518E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    383   -0.1000000000+201    0.8949477859E-04   -0.1000000000+201    0.7056026674E-02    0.7244131743E-07        15     3
 intlbfgs> largest atomic distance between images is     0.3873212760     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.89137E-04 d,cutoff=     3.3326         3.3508     max grad=    0.70431E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133236952        0.1384363152E-01
 intlbfgs> Highest QCI image energy=    0.9605055773E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9605055773E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    384   -0.1000000000+201    0.8913716449E-04   -0.1000000000+201    0.7043131687E-02    0.2695554898E-04        15     3
 intlbfgs> Mean deviation     0.1384363152E-01 Decreasing QCI force constant to      1.394361791    
 intlbfgs> largest atomic distance between images is     0.3873228340     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.89011E-04 d,cutoff=     3.3326         3.3508     max grad=    0.70369E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133237732        0.1385993544E-01
 intlbfgs> Highest QCI image energy=    0.9589330126E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9589330126E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    385   -0.1000000000+201    0.8901116751E-04   -0.1000000000+201    0.7036932303E-02    0.1455553792E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3873217659     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.88883E-04 d,cutoff=     3.3326         3.3508     max grad=    0.70351E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133238141        0.1391007311E-01
 intlbfgs> Highest QCI image energy=    0.9581245404E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9581245404E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    386   -0.1000000000+201    0.8888327647E-04   -0.1000000000+201    0.7035138048E-02    0.2528482929E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3873245003     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.88726E-04 d,cutoff=     3.3326         3.3508     max grad=    0.70261E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133239233        0.1391683625E-01
 intlbfgs> Highest QCI image energy=    0.9559257429E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9559257429E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    387   -0.1000000000+201    0.8872557629E-04   -0.1000000000+201    0.7026091203E-02    0.2676196208E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3873259971     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.88551E-04 d,cutoff=     3.3326         3.3508     max grad=    0.70186E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133240220        0.1395075385E-01
 intlbfgs> Highest QCI image energy=    0.9539566700E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9539566700E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    388   -0.1000000000+201    0.8855133892E-04   -0.1000000000+201    0.7018628956E-02    0.1459862855E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3873260996     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.88523E-04 d,cutoff=     3.3326         3.3508     max grad=    0.70176E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133240363        0.1395963558E-01
 intlbfgs> Highest QCI image energy=    0.9536709387E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9536709387E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    389   -0.1000000000+201    0.8852277031E-04   -0.1000000000+201    0.7017626500E-02    0.2537671774E-05        15     3
 intlbfgs> Mean deviation     0.1395963558E-01 Decreasing QCI force constant to      1.380556229    
 intlbfgs> largest atomic distance between images is     0.3873260907     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.88522E-04 d,cutoff=     3.3326         3.3508     max grad=    0.70176E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133240368        0.1396043047E-01
 intlbfgs> Highest QCI image energy=    0.9536626624E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9536626624E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    390   -0.1000000000+201    0.8852171140E-04   -0.1000000000+201    0.7017604363E-02    0.3421997835E-06        15     3
 intlbfgs> largest atomic distance between images is     0.3873257035     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.88513E-04 d,cutoff=     3.3326         3.3508     max grad=    0.70178E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133240369        0.1397719535E-01
 intlbfgs> Highest QCI image energy=    0.9536611744E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9536611744E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    391   -0.1000000000+201    0.8851333046E-04   -0.1000000000+201    0.7017831021E-02    0.8873048347E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3873261016     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.88522E-04 d,cutoff=     3.3326         3.3508     max grad=    0.70176E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133240368        0.1396070086E-01
 intlbfgs> Highest QCI image energy=    0.9536626390E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9536626390E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    392   -0.1000000000+201    0.8852204061E-04   -0.1000000000+201    0.7017596237E-02    0.8756282313E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3873261002     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.88522E-04 d,cutoff=     3.3326         3.3508     max grad=    0.70176E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133240368        0.1396068785E-01
 intlbfgs> Highest QCI image energy=    0.9536626041E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9536626041E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    393   -0.1000000000+201    0.8852195639E-04   -0.1000000000+201    0.7017598358E-02    0.5312165735E-07        15     3
 intlbfgs> largest atomic distance between images is     0.3873260937     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.88521E-04 d,cutoff=     3.3326         3.3508     max grad=    0.70176E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133240368        0.1396065832E-01
 intlbfgs> Highest QCI image energy=    0.9536622406E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9536622406E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    394   -0.1000000000+201    0.8852142315E-04   -0.1000000000+201    0.7017607115E-02    0.2851524644E-06        15     3
 intlbfgs> Mean deviation     0.1396065832E-01 Decreasing QCI force constant to      1.366887355    
 intlbfgs> largest atomic distance between images is     0.3873292212     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.88050E-04 d,cutoff=     3.3327         3.3508     max grad=    0.69989E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133242941        0.1405640345E-01
 intlbfgs> Highest QCI image energy=    0.9485664167E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9485664167E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    395   -0.1000000000+201    0.8804986272E-04   -0.1000000000+201    0.6998904836E-02    0.3560868849E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3874599888     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.68494E-04 d,cutoff=     3.3348         3.3508     max grad=    0.61697E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133383071        0.1747576098E-01
 intlbfgs> Highest QCI image energy=    0.7311148042E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7311148042E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    396   -0.1000000000+201    0.6849394141E-04   -0.1000000000+201    0.6169655818E-02    0.1729899170E-02        15     3
 intlbfgs> largest atomic distance between images is     0.3873297904     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.87843E-04 d,cutoff=     3.3327         3.3508     max grad=    0.69903E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133244508        0.1403412556E-01
 intlbfgs> Highest QCI image energy=    0.9455301184E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9455301184E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    397   -0.1000000000+201    0.8784290565E-04   -0.1000000000+201    0.6990345442E-02    0.1695948568E-02        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3873369839     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.87089E-04 d,cutoff=     3.3328         3.3508     max grad=    0.69613E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133247550        0.1436931447E-01
 intlbfgs> Highest QCI image energy=    0.9396746132E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9396746132E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    398   -0.1000000000+201    0.8708856717E-04   -0.1000000000+201    0.6961333310E-02    0.1311606407E-03        15     3
 intlbfgs> largest atomic distance between images is     0.3873326112     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.87542E-04 d,cutoff=     3.3327         3.3508     max grad=    0.69787E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133245724        0.1416262648E-01
 intlbfgs> Highest QCI image energy=    0.9431099936E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9431099936E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    399   -0.1000000000+201    0.8754169856E-04   -0.1000000000+201    0.6978738937E-02    0.8182131168E-04        15     3
 intlbfgs> Mean deviation     0.1416262648E-01 Decreasing QCI force constant to      1.353353817    
 intlbfgs> largest atomic distance between images is     0.3873326121     for atom     10 and images      1     2 total images=     1
 checkrep> number of active repulsions and total=      69      69
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.87542E-04 d,cutoff=     3.3327         3.3508     max grad=    0.69787E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133245724        0.1416255127E-01
 intlbfgs> Highest QCI image energy=    0.9431100583E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9431100583E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    400   -0.1000000000+201    0.8754169036E-04   -0.1000000000+201    0.6978738982E-02    0.2913621109E-07        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.3873362523     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.87484E-04 d,cutoff=     3.3327         3.3508     max grad=    0.69779E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133245826        0.1386784828E-01
 intlbfgs> Highest QCI image energy=    0.9431036863E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9431036863E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    401   -0.1000000000+201    0.8748420719E-04   -0.1000000000+201    0.6977934206E-02    0.1161149542E-03        15     3
 intlbfgs> largest atomic distance between images is     0.3873326135     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.87542E-04 d,cutoff=     3.3327         3.3508     max grad=    0.69787E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133245724        0.1416244611E-01
 intlbfgs> Highest QCI image energy=    0.9431099873E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9431099873E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    402   -0.1000000000+201    0.8754167030E-04   -0.1000000000+201    0.6978738359E-02    0.1160723617E-03        15     3
 intlbfgs> largest atomic distance between images is     0.3873326135     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.87542E-04 d,cutoff=     3.3327         3.3508     max grad=    0.69787E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133245724        0.1416245049E-01
 intlbfgs> Highest QCI image energy=    0.9431099198E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9431099198E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    403   -0.1000000000+201    0.8754166066E-04   -0.1000000000+201    0.6978738186E-02    0.1896631263E-08        15     3
 intlbfgs> largest atomic distance between images is     0.3873325973     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.87471E-04 d,cutoff=     3.3327         3.3508     max grad=    0.69768E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133246033        0.1418635456E-01
 intlbfgs> Highest QCI image energy=    0.9425086663E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9425086663E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    404   -0.1000000000+201    0.8747070560E-04   -0.1000000000+201    0.6976806031E-02    0.8935763702E-05        15     3
 intlbfgs> Mean deviation     0.1418635456E-01 Decreasing QCI force constant to      1.339954274    
 intlbfgs> largest atomic distance between images is     0.3873356761     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.87077E-04 d,cutoff=     3.3328         3.3508     max grad=    0.69603E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133248294        0.1425775948E-01
 intlbfgs> Highest QCI image energy=    0.9381195646E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9381195646E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    405   -0.1000000000+201    0.8707689616E-04   -0.1000000000+201    0.6960323782E-02    0.3171465327E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3873509387     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.84718E-04 d,cutoff=     3.3330         3.3508     max grad=    0.68668E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133261688        0.1473792727E-01
 intlbfgs> Highest QCI image energy=    0.9128506240E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9128506240E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    406   -0.1000000000+201    0.8471773416E-04   -0.1000000000+201    0.6866826099E-02    0.1794989788E-03        15     3
 intlbfgs> largest atomic distance between images is     0.3873393595     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.86560E-04 d,cutoff=     3.3328         3.3508     max grad=    0.69393E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133251222        0.1436238723E-01
 intlbfgs> Highest QCI image energy=    0.9324906519E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9324906519E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    407   -0.1000000000+201    0.8655980061E-04   -0.1000000000+201    0.6939278291E-02    0.1404547055E-03        15     3
 intlbfgs> largest atomic distance between images is     0.3873390942     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.86558E-04 d,cutoff=     3.3328         3.3508     max grad=    0.69397E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133251187        0.1436876171E-01
 intlbfgs> Highest QCI image energy=    0.9325579645E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9325579645E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    408   -0.1000000000+201    0.8655822631E-04   -0.1000000000+201    0.6939716374E-02    0.4424683250E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3873392021     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.86559E-04 d,cutoff=     3.3328         3.3508     max grad=    0.69395E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133251204        0.1436632093E-01
 intlbfgs> Highest QCI image energy=    0.9325243877E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9325243877E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    409   -0.1000000000+201    0.8655856617E-04   -0.1000000000+201    0.6939530461E-02    0.1745127103E-05        15     3
 intlbfgs> Mean deviation     0.1436632093E-01 Decreasing QCI force constant to      1.326687400    
 intlbfgs> largest atomic distance between images is     0.3873392021     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.86559E-04 d,cutoff=     3.3328         3.3508     max grad=    0.69395E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133251204        0.1436637712E-01
 intlbfgs> Highest QCI image energy=    0.9325242162E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9325242162E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    410   -0.1000000000+201    0.8655854063E-04   -0.1000000000+201    0.6939530339E-02    0.2291242979E-07        15     3
 intlbfgs> largest atomic distance between images is     0.3873391559     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.86555E-04 d,cutoff=     3.3328         3.3508     max grad=    0.69397E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133251205        0.1438700589E-01
 intlbfgs> Highest QCI image energy=    0.9325239262E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9325239262E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    411   -0.1000000000+201    0.8655471204E-04   -0.1000000000+201    0.6939727501E-02    0.8887265825E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3873392023     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.86559E-04 d,cutoff=     3.3328         3.3508     max grad=    0.69395E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133251204        0.1436640326E-01
 intlbfgs> Highest QCI image energy=    0.9325243439E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9325243439E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    412   -0.1000000000+201    0.8655856237E-04   -0.1000000000+201    0.6939531633E-02    0.8862508176E-05        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3873392023     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.86559E-04 d,cutoff=     3.3328         3.3508     max grad=    0.69395E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133251204        0.1436639337E-01
 intlbfgs> Highest QCI image energy=    0.9325242153E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9325242153E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    413   -0.1000000000+201    0.8655855830E-04   -0.1000000000+201    0.6939531258E-02    0.4839733341E-08        15     3
 intlbfgs> largest atomic distance between images is     0.3873394368     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.86535E-04 d,cutoff=     3.3328         3.3508     max grad=    0.69383E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133251397        0.1435604200E-01
 intlbfgs> Highest QCI image energy=    0.9321575662E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9321575662E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    414   -0.1000000000+201    0.8653533194E-04   -0.1000000000+201    0.6938297052E-02    0.7107893972E-05        15     3
 intlbfgs> Mean deviation     0.1435604200E-01 Decreasing QCI force constant to      1.313551881    
 intlbfgs> largest atomic distance between images is     0.3873423492     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.86085E-04 d,cutoff=     3.3329         3.3508     max grad=    0.69206E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133253887        0.1446443971E-01
 intlbfgs> Highest QCI image energy=    0.9274177013E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9274177013E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    415   -0.1000000000+201    0.8608460004E-04   -0.1000000000+201    0.6920614291E-02    0.3416198179E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3873672893     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.82234E-04 d,cutoff=     3.3333         3.3508     max grad=    0.67661E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133276723        0.1523057831E-01
 intlbfgs> Highest QCI image energy=    0.8858505349E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8858505349E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    416   -0.1000000000+201    0.8223394366E-04   -0.1000000000+201    0.6766074677E-02    0.2988414493E-03        15     3
 intlbfgs> largest atomic distance between images is     0.3873458502     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.85565E-04 d,cutoff=     3.3329         3.3508     max grad=    0.68999E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133256827        0.1457954970E-01
 intlbfgs> Highest QCI image energy=    0.9218783181E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9218783181E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    417   -0.1000000000+201    0.8556540426E-04   -0.1000000000+201    0.6899856072E-02    0.2602054026E-03        15     3
 intlbfgs> largest atomic distance between images is     0.3873458539     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.85579E-04 d,cutoff=     3.3329         3.3508     max grad=    0.69001E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133256793        0.1456539804E-01
 intlbfgs> Highest QCI image energy=    0.9219420610E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9219420610E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    418   -0.1000000000+201    0.8557938963E-04   -0.1000000000+201    0.6900137393E-02    0.4934331132E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3873458573     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.85573E-04 d,cutoff=     3.3329         3.3508     max grad=    0.69000E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133256810        0.1457184989E-01
 intlbfgs> Highest QCI image energy=    0.9219100139E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9219100139E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    419   -0.1000000000+201    0.8557275493E-04   -0.1000000000+201    0.6899991837E-02    0.2059294867E-05        15     3
 intlbfgs> Mean deviation     0.1457184989E-01 Decreasing QCI force constant to      1.300546417    
 intlbfgs> largest atomic distance between images is     0.3873458575     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.85573E-04 d,cutoff=     3.3329         3.3508     max grad=    0.69000E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133256810        0.1457195907E-01
 intlbfgs> Highest QCI image energy=    0.9219098034E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9219098034E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    420   -0.1000000000+201    0.8557272379E-04   -0.1000000000+201    0.6899990334E-02    0.4497587302E-07        15     3
 intlbfgs> largest atomic distance between images is     0.3873459970     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.85561E-04 d,cutoff=     3.3329         3.3508     max grad=    0.68993E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133256826        0.1467348907E-01
 intlbfgs> Highest QCI image energy=    0.9219075192E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9219075192E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    421   -0.1000000000+201    0.8556118299E-04   -0.1000000000+201    0.6899266161E-02    0.4347899533E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3873458571     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.85573E-04 d,cutoff=     3.3329         3.3508     max grad=    0.69000E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133256810        0.1457210289E-01
 intlbfgs> Highest QCI image energy=    0.9219099935E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9219099935E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    422   -0.1000000000+201    0.8557272014E-04   -0.1000000000+201    0.6899990585E-02    0.4342286129E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3873458571     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.85573E-04 d,cutoff=     3.3329         3.3508     max grad=    0.69000E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133256810        0.1457210528E-01
 intlbfgs> Highest QCI image energy=    0.9219097962E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9219097962E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    423   -0.1000000000+201    0.8557269942E-04   -0.1000000000+201    0.6899989968E-02    0.2629637114E-08        15     3
 intlbfgs> largest atomic distance between images is     0.3873469291     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.85320E-04 d,cutoff=     3.3330         3.3508     max grad=    0.68910E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133258189        0.1461361622E-01
 intlbfgs> Highest QCI image energy=    0.9193341141E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9193341141E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    424   -0.1000000000+201    0.8532047528E-04   -0.1000000000+201    0.6890960261E-02    0.2169972936E-04        15     3
 intlbfgs> Mean deviation     0.1461361622E-01 Decreasing QCI force constant to      1.287669720    
 intlbfgs> largest atomic distance between images is     0.3873491550     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.85082E-04 d,cutoff=     3.3330         3.3508     max grad=    0.68802E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133259644        0.1467445270E-01
 intlbfgs> Highest QCI image energy=    0.9166246725E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9166246725E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    425   -0.1000000000+201    0.8508183250E-04   -0.1000000000+201    0.6880230910E-02    0.2280142572E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3873496792     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.84799E-04 d,cutoff=     3.3330         3.3508     max grad=    0.68713E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133261152        0.1468746950E-01
 intlbfgs> Highest QCI image energy=    0.9138525627E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9138525627E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    426   -0.1000000000+201    0.8479861962E-04   -0.1000000000+201    0.6871303026E-02    0.3867568335E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3873552568     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.84372E-04 d,cutoff=     3.3331         3.3508     max grad=    0.68492E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133263984        0.1480495023E-01
 intlbfgs> Highest QCI image energy=    0.9086359354E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9086359354E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    427   -0.1000000000+201    0.8437240784E-04   -0.1000000000+201    0.6849203109E-02    0.6016112285E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3873525216     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.84605E-04 d,cutoff=     3.3330         3.3508     max grad=    0.68608E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133262430        0.1477481193E-01
 intlbfgs> Highest QCI image energy=    0.9114764700E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9114764700E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    428   -0.1000000000+201    0.8460461749E-04   -0.1000000000+201    0.6860808325E-02    0.2735893513E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3873525690     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.84589E-04 d,cutoff=     3.3330         3.3508     max grad=    0.68603E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133262518        0.1477721705E-01
 intlbfgs> Highest QCI image energy=    0.9113144820E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9113144820E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    429   -0.1000000000+201    0.8458914529E-04   -0.1000000000+201    0.6860278974E-02    0.1652575220E-05        15     3
 intlbfgs> Mean deviation     0.1477721705E-01 Decreasing QCI force constant to      1.274920515    
 intlbfgs> largest atomic distance between images is     0.3873525802     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.84584E-04 d,cutoff=     3.3330         3.3508     max grad=    0.68601E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133262544        0.1477922018E-01
 intlbfgs> Highest QCI image energy=    0.9112682274E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9112682274E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    430   -0.1000000000+201    0.8458437929E-04   -0.1000000000+201    0.6860118390E-02    0.6918491489E-06        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3873526637     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.84582E-04 d,cutoff=     3.3330         3.3508     max grad=    0.68599E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133262568        0.1477673183E-01
 intlbfgs> Highest QCI image energy=    0.9112242881E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9112242881E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    431   -0.1000000000+201    0.8458226092E-04   -0.1000000000+201    0.6859913624E-02    0.1546497654E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3873536484     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.84499E-04 d,cutoff=     3.3330         3.3508     max grad=    0.68557E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133263161        0.1477884777E-01
 intlbfgs> Highest QCI image energy=    0.9101367402E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9101367402E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    432   -0.1000000000+201    0.8449920890E-04   -0.1000000000+201    0.6855668519E-02    0.1070337935E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3873554062     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.84260E-04 d,cutoff=     3.3331         3.3508     max grad=    0.68457E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133264587        0.1482516103E-01
 intlbfgs> Highest QCI image energy=    0.9075283845E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9075283845E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    433   -0.1000000000+201    0.8426033305E-04   -0.1000000000+201    0.6845671981E-02    0.1904322795E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3873560663     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.84114E-04 d,cutoff=     3.3331         3.3508     max grad=    0.68405E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133265379        0.1486754560E-01
 intlbfgs> Highest QCI image energy=    0.9060837824E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9060837824E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    434   -0.1000000000+201    0.8411410305E-04   -0.1000000000+201    0.6840455677E-02    0.1193045049E-04        15     3
 intlbfgs> Mean deviation     0.1486754560E-01 Decreasing QCI force constant to      1.262297539    
 intlbfgs> largest atomic distance between images is     0.3873559544     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.84089E-04 d,cutoff=     3.3331         3.3508     max grad=    0.68401E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133265459        0.1488395958E-01
 intlbfgs> Highest QCI image energy=    0.9059366901E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9059366901E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    435   -0.1000000000+201    0.8408893282E-04   -0.1000000000+201    0.6840052181E-02    0.5551831017E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3872656146     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.68504E-04 d,cutoff=     3.3348         3.3508     max grad=    0.66252E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133424840        0.2638662791E-01
 intlbfgs> Highest QCI image energy=    0.9247185412E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9247185412E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    436   -0.1000000000+201    0.6850368499E-04   -0.1000000000+201    0.6625200312E-02    0.3997851261E-02        15     3
 intlbfgs> largest atomic distance between images is     0.3873558132     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.84069E-04 d,cutoff=     3.3331         3.3508     max grad=    0.68399E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133265511        0.1489937490E-01
 intlbfgs> Highest QCI image energy=    0.9058425021E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9058425021E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    437   -0.1000000000+201    0.8406869307E-04   -0.1000000000+201    0.6839850627E-02    0.3992225333E-02        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3873558298     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.84066E-04 d,cutoff=     3.3331         3.3508     max grad=    0.68397E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133265526        0.1489985105E-01
 intlbfgs> Highest QCI image energy=    0.9058155166E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9058155166E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    438   -0.1000000000+201    0.8406624810E-04   -0.1000000000+201    0.6839749217E-02    0.1985767642E-06        15     3
 intlbfgs> largest atomic distance between images is     0.3873592949     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.83595E-04 d,cutoff=     3.3331         3.3508     max grad=    0.68200E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133268394        0.1499117663E-01
 intlbfgs> Highest QCI image energy=    0.9006227566E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9006227566E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    439   -0.1000000000+201    0.8359468737E-04   -0.1000000000+201    0.6819993731E-02    0.3771884124E-04        15     3
 intlbfgs> Mean deviation     0.1499117663E-01 Decreasing QCI force constant to      1.249799544    
 intlbfgs> largest atomic distance between images is     0.3873593493     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.83594E-04 d,cutoff=     3.3331         3.3508     max grad=    0.68199E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133268403        0.1498894857E-01
 intlbfgs> Highest QCI image energy=    0.9006063930E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9006063930E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    440   -0.1000000000+201    0.8359418642E-04   -0.1000000000+201    0.6819939942E-02    0.1053397652E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3873648261     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.83683E-04 d,cutoff=     3.3331         3.3508     max grad=    0.68196E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133268713        0.1469075733E-01
 intlbfgs> Highest QCI image energy=    0.9002725330E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9002725330E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    441   -0.1000000000+201    0.8368308729E-04   -0.1000000000+201    0.6819561687E-02    0.1253635837E-03        15     3
 intlbfgs> largest atomic distance between images is     0.3873594014     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.83596E-04 d,cutoff=     3.3331         3.3508     max grad=    0.68200E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133268398        0.1498576958E-01
 intlbfgs> Highest QCI image energy=    0.9006156213E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9006156213E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    442   -0.1000000000+201    0.8359589126E-04   -0.1000000000+201    0.6819970301E-02    0.1240046904E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3873594111     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.83595E-04 d,cutoff=     3.3331         3.3508     max grad=    0.68199E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133268405        0.1498618286E-01
 intlbfgs> Highest QCI image energy=    0.9006027763E-04 images=       1
 intlbfgs> Highest image        2 energy     0.9006027763E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    443   -0.1000000000+201    0.8359452800E-04   -0.1000000000+201    0.6819914666E-02    0.1282786319E-06        15     3
 intlbfgs> largest atomic distance between images is     0.3873620634     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.83203E-04 d,cutoff=     3.3332         3.3508     max grad=    0.68040E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133270642        0.1508290022E-01
 intlbfgs> Highest QCI image energy=    0.8965897903E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8965897903E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    444   -0.1000000000+201    0.8320313303E-04   -0.1000000000+201    0.6804036330E-02    0.3034265754E-04        15     3
 intlbfgs> Mean deviation     0.1508290022E-01 Decreasing QCI force constant to      1.237425291    
 intlbfgs> largest atomic distance between images is     0.3873627533     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.83096E-04 d,cutoff=     3.3332         3.3508     max grad=    0.67997E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133271397        0.1509378760E-01
 intlbfgs> Highest QCI image energy=    0.8952404086E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8952404086E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    445   -0.1000000000+201    0.8309583440E-04   -0.1000000000+201    0.6799670291E-02    0.1313386239E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3873633020     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.83008E-04 d,cutoff=     3.3332         3.3508     max grad=    0.67962E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133271594        0.1515554749E-01
 intlbfgs> Highest QCI image energy=    0.8949039524E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8949039524E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    446   -0.1000000000+201    0.8300779148E-04   -0.1000000000+201    0.6796185389E-02    0.2759604221E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3873633960     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.82957E-04 d,cutoff=     3.3332         3.3508     max grad=    0.67942E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133272189        0.1513751778E-01
 intlbfgs> Highest QCI image energy=    0.8938287788E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8938287788E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    447   -0.1000000000+201    0.8295694460E-04   -0.1000000000+201    0.6794225014E-02    0.2629515892E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3873642133     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.82835E-04 d,cutoff=     3.3332         3.3508     max grad=    0.67892E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133273004        0.1515700263E-01
 intlbfgs> Highest QCI image energy=    0.8923820891E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8923820891E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    448   -0.1000000000+201    0.8283486820E-04   -0.1000000000+201    0.6789192609E-02    0.1187799480E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3873657290     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.82646E-04 d,cutoff=     3.3332         3.3508     max grad=    0.67813E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133274166        0.1519154797E-01
 intlbfgs> Highest QCI image energy=    0.8903236340E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8903236340E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    449   -0.1000000000+201    0.8264619208E-04   -0.1000000000+201    0.6781289778E-02    0.1522099975E-04        15     3
 intlbfgs> Mean deviation     0.1519154797E-01 Decreasing QCI force constant to      1.225173555    
 intlbfgs> largest atomic distance between images is     0.3873661969     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.82600E-04 d,cutoff=     3.3332         3.3508     max grad=    0.67793E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133274404        0.1520121290E-01
 intlbfgs> Highest QCI image energy=    0.8899033545E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8899033545E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    450   -0.1000000000+201    0.8259965158E-04   -0.1000000000+201    0.6779345124E-02    0.6289977243E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3873671262     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.82545E-04 d,cutoff=     3.3332         3.3508     max grad=    0.67770E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133274468        0.1522102169E-01
 intlbfgs> Highest QCI image energy=    0.8898027047E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8898027047E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    451   -0.1000000000+201    0.8254481382E-04   -0.1000000000+201    0.6777049740E-02    0.2750953178E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3873663982     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.82601E-04 d,cutoff=     3.3332         3.3508     max grad=    0.67792E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133274412        0.1519415817E-01
 intlbfgs> Highest QCI image energy=    0.8898897040E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8898897040E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    452   -0.1000000000+201    0.8260097599E-04   -0.1000000000+201    0.6779243790E-02    0.2566411272E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3873664055     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.82600E-04 d,cutoff=     3.3332         3.3508     max grad=    0.67792E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133274421        0.1519423425E-01
 intlbfgs> Highest QCI image energy=    0.8898738307E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8898738307E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    453   -0.1000000000+201    0.8259980713E-04   -0.1000000000+201    0.6779188221E-02    0.2672540657E-06        15     3
 intlbfgs> largest atomic distance between images is     0.3873677092     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.82400E-04 d,cutoff=     3.3333         3.3508     max grad=    0.67706E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133275738        0.1522752536E-01
 intlbfgs> Highest QCI image energy=    0.8875554341E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8875554341E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    454   -0.1000000000+201    0.8239962929E-04   -0.1000000000+201    0.6770638085E-02    0.2174925113E-04        15     3
 intlbfgs> Mean deviation     0.1522752536E-01 Decreasing QCI force constant to      1.213043124    
 intlbfgs> largest atomic distance between images is     0.3873696833     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.82098E-04 d,cutoff=     3.3333         3.3508     max grad=    0.67588E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133277464        0.1530666513E-01
 intlbfgs> Highest QCI image energy=    0.8845256623E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8845256623E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    455   -0.1000000000+201    0.8209767532E-04   -0.1000000000+201    0.6758834704E-02    0.2544730294E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3873713346     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.81768E-04 d,cutoff=     3.3333         3.3508     max grad=    0.67452E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133279741        0.1536459680E-01
 intlbfgs> Highest QCI image energy=    0.8805776903E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8805776903E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    456   -0.1000000000+201    0.8176825571E-04   -0.1000000000+201    0.6745162664E-02    0.4389517680E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3873743934     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.81227E-04 d,cutoff=     3.3334         3.3508     max grad=    0.67258E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133282478        0.1555829468E-01
 intlbfgs> Highest QCI image energy=    0.8758434665E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8758434665E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    457   -0.1000000000+201    0.8122709497E-04   -0.1000000000+201    0.6725769890E-02    0.6927218589E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3873730655     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.81623E-04 d,cutoff=     3.3333         3.3508     max grad=    0.67391E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133280424        0.1541008809E-01
 intlbfgs> Highest QCI image energy=    0.8793754566E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8793754566E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    458   -0.1000000000+201    0.8162343490E-04   -0.1000000000+201    0.6739132875E-02    0.3930954902E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3873731078     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.81607E-04 d,cutoff=     3.3333         3.3508     max grad=    0.67386E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133280518        0.1541253306E-01
 intlbfgs> Highest QCI image energy=    0.8792125630E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8792125630E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    459   -0.1000000000+201    0.8160686998E-04   -0.1000000000+201    0.6738583500E-02    0.2115712992E-05        15     3
 intlbfgs> Mean deviation     0.1541253306E-01 Decreasing QCI force constant to      1.201032796    
 intlbfgs> largest atomic distance between images is     0.3873731216     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.81607E-04 d,cutoff=     3.3333         3.3508     max grad=    0.67386E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133280516        0.1541188123E-01
 intlbfgs> Highest QCI image energy=    0.8792170907E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8792170907E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    460   -0.1000000000+201    0.8160741451E-04   -0.1000000000+201    0.6738587639E-02    0.2373274370E-06        15     3
 intlbfgs> largest atomic distance between images is     0.3873734414     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.81608E-04 d,cutoff=     3.3333         3.3508     max grad=    0.67383E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133280520        0.1540177489E-01
 intlbfgs> Highest QCI image energy=    0.8792093957E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8792093957E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    461   -0.1000000000+201    0.8160763657E-04   -0.1000000000+201    0.6738301823E-02    0.4816757102E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3873731011     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.81600E-04 d,cutoff=     3.3333         3.3508     max grad=    0.67385E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133280527        0.1541440522E-01
 intlbfgs> Highest QCI image energy=    0.8791973439E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8791973439E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    462   -0.1000000000+201    0.8160047010E-04   -0.1000000000+201    0.6738514437E-02    0.4418555050E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3873730775     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.81604E-04 d,cutoff=     3.3333         3.3508     max grad=    0.67385E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133280532        0.1541376777E-01
 intlbfgs> Highest QCI image energy=    0.8791893204E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8791893204E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    463   -0.1000000000+201    0.8160427623E-04   -0.1000000000+201    0.6738548580E-02    0.2281695058E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3873730701     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.81602E-04 d,cutoff=     3.3333         3.3508     max grad=    0.67384E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133280555        0.1541529689E-01
 intlbfgs> Highest QCI image energy=    0.8791497231E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8791497231E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    464   -0.1000000000+201    0.8160212437E-04   -0.1000000000+201    0.6738432510E-02    0.1143657780E-05        15     3
 intlbfgs> Mean deviation     0.1541529689E-01 Decreasing QCI force constant to      1.189141382    
 intlbfgs> largest atomic distance between images is     0.3873772888     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.81022E-04 d,cutoff=     3.3334         3.3508     max grad=    0.67145E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133284169        0.1553075407E-01
 intlbfgs> Highest QCI image energy=    0.8729298202E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8729298202E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    465   -0.1000000000+201    0.8102239055E-04   -0.1000000000+201    0.6714483762E-02    0.4551996079E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3873979436     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.77991E-04 d,cutoff=     3.3337         3.3508     max grad=    0.65881E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133303557        0.1631139123E-01
 intlbfgs> Highest QCI image energy=    0.8407540972E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8407540972E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    466   -0.1000000000+201    0.7799116757E-04   -0.1000000000+201    0.6588121841E-02    0.2411198884E-03        15     3
 intlbfgs> largest atomic distance between images is     0.3873801021     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.80610E-04 d,cutoff=     3.3335         3.3508     max grad=    0.66974E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133286781        0.1562473606E-01
 intlbfgs> Highest QCI image energy=    0.8684786289E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8684786289E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    467   -0.1000000000+201    0.8061035545E-04   -0.1000000000+201    0.6697426662E-02    0.2088425882E-03        15     3
 intlbfgs> largest atomic distance between images is     0.3873800995     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.80612E-04 d,cutoff=     3.3335         3.3508     max grad=    0.66975E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133286765        0.1562628806E-01
 intlbfgs> Highest QCI image energy=    0.8685044596E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8685044596E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    468   -0.1000000000+201    0.8061216852E-04   -0.1000000000+201    0.6697450735E-02    0.1177024361E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3873801013     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.80612E-04 d,cutoff=     3.3335         3.3508     max grad=    0.66974E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133286769        0.1562584421E-01
 intlbfgs> Highest QCI image energy=    0.8684976630E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8684976630E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    469   -0.1000000000+201    0.8061175032E-04   -0.1000000000+201    0.6697441779E-02    0.2673279607E-06        15     3
 intlbfgs> Mean deviation     0.1562584421E-01 Decreasing QCI force constant to      1.177367705    
 intlbfgs> largest atomic distance between images is     0.3873801010     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.80612E-04 d,cutoff=     3.3335         3.3508     max grad=    0.66974E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133286769        0.1562584234E-01
 intlbfgs> Highest QCI image energy=    0.8684976236E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8684976236E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    470   -0.1000000000+201    0.8061174291E-04   -0.1000000000+201    0.6697441766E-02    0.7679803283E-08        15     3
 intlbfgs> largest atomic distance between images is     0.3873798735     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.80609E-04 d,cutoff=     3.3335         3.3508     max grad=    0.66976E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133286770        0.1562361731E-01
 intlbfgs> Highest QCI image energy=    0.8684976274E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8684976274E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    471   -0.1000000000+201    0.8060869463E-04   -0.1000000000+201    0.6697553460E-02    0.6270297715E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3873801004     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.80612E-04 d,cutoff=     3.3335         3.3508     max grad=    0.66974E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133286769        0.1562584959E-01
 intlbfgs> Highest QCI image energy=    0.8684976532E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8684976532E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    472   -0.1000000000+201    0.8061173965E-04   -0.1000000000+201    0.6697442291E-02    0.6262106402E-05        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3873801005     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.80612E-04 d,cutoff=     3.3335         3.3508     max grad=    0.66974E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133286769        0.1562585182E-01
 intlbfgs> Highest QCI image energy=    0.8684976235E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8684976235E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    473   -0.1000000000+201    0.8061173595E-04   -0.1000000000+201    0.6697442140E-02    0.1760571225E-08        15     3
 intlbfgs> largest atomic distance between images is     0.3873804098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.80593E-04 d,cutoff=     3.3335         3.3508     max grad=    0.66966E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133286880        0.1563291971E-01
 intlbfgs> Highest QCI image energy=    0.8683096132E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8683096132E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    474   -0.1000000000+201    0.8059291114E-04   -0.1000000000+201    0.6696609791E-02    0.5629421983E-05        15     3
 intlbfgs> Mean deviation     0.1563291971E-01 Decreasing QCI force constant to      1.165710599    
 intlbfgs> largest atomic distance between images is     0.3873839874     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.80053E-04 d,cutoff=     3.3335         3.3508     max grad=    0.66743E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133290347        0.1574404473E-01
 intlbfgs> Highest QCI image energy=    0.8624599757E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8624599757E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    475   -0.1000000000+201    0.8005266726E-04   -0.1000000000+201    0.6674273939E-02    0.4331821343E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3874199203     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.75063E-04 d,cutoff=     3.3341         3.3508     max grad=    0.64626E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133323752        0.1688245038E-01
 intlbfgs> Highest QCI image energy=    0.8091421679E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8091421679E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    476   -0.1000000000+201    0.7506274542E-04   -0.1000000000+201    0.6462598111E-02    0.4001581015E-03        15     3
 intlbfgs> largest atomic distance between images is     0.3873871247     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.79615E-04 d,cutoff=     3.3336         3.3508     max grad=    0.66560E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133293160        0.1584078026E-01
 intlbfgs> Highest QCI image energy=    0.8577588809E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8577588809E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    477   -0.1000000000+201    0.7961499010E-04   -0.1000000000+201    0.6656012576E-02    0.3656677729E-03        15     3
 intlbfgs> largest atomic distance between images is     0.3873871386     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.79615E-04 d,cutoff=     3.3336         3.3508     max grad=    0.66560E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133293155        0.1584173296E-01
 intlbfgs> Highest QCI image energy=    0.8577674484E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8577674484E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    478   -0.1000000000+201    0.7961489667E-04   -0.1000000000+201    0.6655991381E-02    0.6694554444E-06        15     3
 intlbfgs> largest atomic distance between images is     0.3873871386     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.79615E-04 d,cutoff=     3.3336         3.3508     max grad=    0.66560E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133293156        0.1584161292E-01
 intlbfgs> Highest QCI image energy=    0.8577656060E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8577656060E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    479   -0.1000000000+201    0.7961487604E-04   -0.1000000000+201    0.6655993021E-02    0.1250092827E-06        15     3
 intlbfgs> Mean deviation     0.1584161292E-01 Decreasing QCI force constant to      1.154168910    
 intlbfgs> largest atomic distance between images is     0.3873871396     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.79615E-04 d,cutoff=     3.3336         3.3508     max grad=    0.66560E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133293157        0.1584161367E-01
 intlbfgs> Highest QCI image energy=    0.8577653696E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8577653696E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    480   -0.1000000000+201    0.7961486670E-04   -0.1000000000+201    0.6655992249E-02    0.3014302972E-07        15     3
 intlbfgs> largest atomic distance between images is     0.3873874171     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.79619E-04 d,cutoff=     3.3336         3.3508     max grad=    0.66560E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133293158        0.1584036483E-01
 intlbfgs> Highest QCI image energy=    0.8577650466E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8577650466E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    481   -0.1000000000+201    0.7961872886E-04   -0.1000000000+201    0.6656035248E-02    0.9335681785E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3873871406     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.79615E-04 d,cutoff=     3.3336         3.3508     max grad=    0.66560E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133293156        0.1584160711E-01
 intlbfgs> Highest QCI image energy=    0.8577655383E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8577655383E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    482   -0.1000000000+201    0.7961489700E-04   -0.1000000000+201    0.6655992663E-02    0.9308628196E-05        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3873871406     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.79615E-04 d,cutoff=     3.3336         3.3508     max grad=    0.66560E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133293157        0.1584160791E-01
 intlbfgs> Highest QCI image energy=    0.8577653684E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8577653684E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    483   -0.1000000000+201    0.7961488191E-04   -0.1000000000+201    0.6655992013E-02    0.6333600233E-08        15     3
 intlbfgs> largest atomic distance between images is     0.3873872430     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.79571E-04 d,cutoff=     3.3336         3.3508     max grad=    0.66542E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133293440        0.1584875590E-01
 intlbfgs> Highest QCI image energy=    0.8572954699E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8572954699E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    484   -0.1000000000+201    0.7957078028E-04   -0.1000000000+201    0.6654160638E-02    0.9033659203E-05        15     3
 intlbfgs> Mean deviation     0.1584875590E-01 Decreasing QCI force constant to      1.142741495    
 intlbfgs> largest atomic distance between images is     0.3873909557     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.79074E-04 d,cutoff=     3.3336         3.3508     max grad=    0.66335E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133296672        0.1595910581E-01
 intlbfgs> Highest QCI image energy=    0.8519486826E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8519486826E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    485   -0.1000000000+201    0.7907418932E-04   -0.1000000000+201    0.6633506563E-02    0.4069133435E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3875192524     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.62656E-04 d,cutoff=     3.3355         3.3508     max grad=    0.59081E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133423963        0.1978872298E-01
 intlbfgs> Highest QCI image energy=    0.6753026041E-04 images=       1
 intlbfgs> Highest image        2 energy     0.6753026041E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    486   -0.1000000000+201    0.6265646086E-04   -0.1000000000+201    0.5908130697E-02    0.1393715586E-02        15     3
 intlbfgs> largest atomic distance between images is     0.3873942791     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.78621E-04 d,cutoff=     3.3337         3.3508     max grad=    0.66144E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133299652        0.1605897440E-01
 intlbfgs> Highest QCI image energy=    0.8470663616E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8470663616E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    487   -0.1000000000+201    0.7862096278E-04   -0.1000000000+201    0.6614423332E-02    0.1357632312E-02        15     3
 intlbfgs> largest atomic distance between images is     0.3873942559     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.78619E-04 d,cutoff=     3.3337         3.3508     max grad=    0.66143E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133299664        0.1605883142E-01
 intlbfgs> Highest QCI image energy=    0.8470458584E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8470458584E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    488   -0.1000000000+201    0.7861919742E-04   -0.1000000000+201    0.6614343836E-02    0.1554001790E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3873942425     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.78617E-04 d,cutoff=     3.3337         3.3508     max grad=    0.66142E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133299678        0.1605910812E-01
 intlbfgs> Highest QCI image energy=    0.8470226501E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8470226501E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    489   -0.1000000000+201    0.7861692150E-04   -0.1000000000+201    0.6614234744E-02    0.1551260632E-05        15     3
 intlbfgs> Mean deviation     0.1605910812E-01 Decreasing QCI force constant to      1.131427223    
 intlbfgs> largest atomic distance between images is     0.3873942407     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.78617E-04 d,cutoff=     3.3337         3.3508     max grad=    0.66142E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133299678        0.1605896625E-01
 intlbfgs> Highest QCI image energy=    0.8470227253E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8470227253E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    490   -0.1000000000+201    0.7861703762E-04   -0.1000000000+201    0.6614240698E-02    0.7217169597E-07        15     3
 intlbfgs> largest atomic distance between images is     0.3873778984     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.79627E-04 d,cutoff=     3.3336         3.3508     max grad=    0.66666E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133303033        0.1474471051E-01
 intlbfgs> Highest QCI image energy=    0.8507184270E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8507184270E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    491   -0.1000000000+201    0.7962718110E-04   -0.1000000000+201    0.6666641710E-02    0.6777108729E-03        15     3
 intlbfgs> largest atomic distance between images is     0.3873942394     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.78617E-04 d,cutoff=     3.3337         3.3508     max grad=    0.66142E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133299678        0.1605885863E-01
 intlbfgs> Highest QCI image energy=    0.8470226125E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8470226125E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    492   -0.1000000000+201    0.7861711035E-04   -0.1000000000+201    0.6614244759E-02    0.6776537201E-03        15     3
 intlbfgs> largest atomic distance between images is     0.3873942395     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.78617E-04 d,cutoff=     3.3337         3.3508     max grad=    0.66142E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133299678        0.1605886298E-01
 intlbfgs> Highest QCI image energy=    0.8470225166E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8470225166E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    493   -0.1000000000+201    0.7861709969E-04   -0.1000000000+201    0.6614244310E-02    0.1329754339E-08        15     3
 intlbfgs> largest atomic distance between images is     0.3873961357     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.78368E-04 d,cutoff=     3.3337         3.3508     max grad=    0.66038E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133301203        0.1613439126E-01
 intlbfgs> Highest QCI image energy=    0.8445441758E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8445441758E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    494   -0.1000000000+201    0.7836849874E-04   -0.1000000000+201    0.6603784340E-02    0.2233651686E-04        15     3
 intlbfgs> Mean deviation     0.1613439126E-01 Decreasing QCI force constant to      1.120224973    
 intlbfgs> largest atomic distance between images is     0.3873978005     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.78120E-04 d,cutoff=     3.3337         3.3508     max grad=    0.65934E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133302973        0.1616715596E-01
 intlbfgs> Highest QCI image energy=    0.8416762092E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8416762092E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    495   -0.1000000000+201    0.7812008936E-04   -0.1000000000+201    0.6593371915E-02    0.2405173982E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3874001324     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.77858E-04 d,cutoff=     3.3337         3.3508     max grad=    0.65821E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133304319        0.1629505863E-01
 intlbfgs> Highest QCI image energy=    0.8395372988E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8395372988E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    496   -0.1000000000+201    0.7785788960E-04   -0.1000000000+201    0.6582088156E-02    0.4440834972E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3874019784     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.77549E-04 d,cutoff=     3.3338         3.3508     max grad=    0.65691E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133306827        0.1628181348E-01
 intlbfgs> Highest QCI image energy=    0.8354880962E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8354880962E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    497   -0.1000000000+201    0.7754860833E-04   -0.1000000000+201    0.6569101933E-02    0.5212015334E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3874013822     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.77621E-04 d,cutoff=     3.3338         3.3508     max grad=    0.65723E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133306314        0.1627586269E-01
 intlbfgs> Highest QCI image energy=    0.8363069102E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8363069102E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    498   -0.1000000000+201    0.7762129340E-04   -0.1000000000+201    0.6572316072E-02    0.6608693810E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3874014075     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.77618E-04 d,cutoff=     3.3338         3.3508     max grad=    0.65722E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133306336        0.1627778571E-01
 intlbfgs> Highest QCI image energy=    0.8362717354E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8362717354E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    499   -0.1000000000+201    0.7761827960E-04   -0.1000000000+201    0.6572181635E-02    0.4559874973E-06        15     3
 intlbfgs> Mean deviation     0.1627778571E-01 Decreasing QCI force constant to      1.109133637    
 intlbfgs> largest atomic distance between images is     0.3874014043     for atom     10 and images      1     2 total images=     1
 checkrep> number of active repulsions and total=      69      69
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.77618E-04 d,cutoff=     3.3338         3.3508     max grad=    0.65722E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133306336        0.1627794400E-01
 intlbfgs> Highest QCI image energy=    0.8362721667E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8362721667E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    500   -0.1000000000+201    0.7761840455E-04   -0.1000000000+201    0.6572188181E-02    0.7388703959E-07        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.3874001884     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.77654E-04 d,cutoff=     3.3338         3.3508     max grad=    0.65742E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133306346        0.1634703729E-01
 intlbfgs> Highest QCI image energy=    0.8362675950E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8362675950E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    501   -0.1000000000+201    0.7765391147E-04   -0.1000000000+201    0.6574179426E-02    0.3069727670E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3874014024     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.77619E-04 d,cutoff=     3.3338         3.3508     max grad=    0.65722E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133306336        0.1627812500E-01
 intlbfgs> Highest QCI image energy=    0.8362716705E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8362716705E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    502   -0.1000000000+201    0.7761851411E-04   -0.1000000000+201    0.6572191120E-02    0.3060285590E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3874014025     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.77618E-04 d,cutoff=     3.3338         3.3508     max grad=    0.65722E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133306337        0.1627817457E-01
 intlbfgs> Highest QCI image energy=    0.8362711938E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8362711938E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    503   -0.1000000000+201    0.7761843491E-04   -0.1000000000+201    0.6572188824E-02    0.1342058739E-07        15     3
 intlbfgs> largest atomic distance between images is     0.3874017356     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.77536E-04 d,cutoff=     3.3338         3.3508     max grad=    0.65693E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133306745        0.1631803171E-01
 intlbfgs> Highest QCI image energy=    0.8356200664E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8356200664E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    504   -0.1000000000+201    0.7753576843E-04   -0.1000000000+201    0.6569330954E-02    0.1004280853E-04        15     3
 intlbfgs> Mean deviation     0.1631803171E-01 Decreasing QCI force constant to      1.098152116    
 intlbfgs> largest atomic distance between images is     0.3874048079     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.77143E-04 d,cutoff=     3.3338         3.3508     max grad=    0.65522E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133309531        0.1638362083E-01
 intlbfgs> Highest QCI image energy=    0.8311875686E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8311875686E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    505   -0.1000000000+201    0.7714313434E-04   -0.1000000000+201    0.6552186742E-02    0.3385378533E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3874210365     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.74857E-04 d,cutoff=     3.3341         3.3508     max grad=    0.64565E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133325035        0.1690084911E-01
 intlbfgs> Highest QCI image energy=    0.8071829119E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8071829119E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    506   -0.1000000000+201    0.7485712143E-04   -0.1000000000+201    0.6456460628E-02    0.1826697581E-03        15     3
 intlbfgs> largest atomic distance between images is     0.3874087634     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.76624E-04 d,cutoff=     3.3339         3.3508     max grad=    0.65297E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133313167        0.1648353170E-01
 intlbfgs> Highest QCI image energy=    0.8254601313E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8254601313E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    507   -0.1000000000+201    0.7662430766E-04   -0.1000000000+201    0.6529735430E-02    0.1410906452E-03        15     3
 intlbfgs> largest atomic distance between images is     0.3874085487     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.76619E-04 d,cutoff=     3.3339         3.3508     max grad=    0.65300E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133313079        0.1650571885E-01
 intlbfgs> Highest QCI image energy=    0.8255973904E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8255973904E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    508   -0.1000000000+201    0.7661908071E-04   -0.1000000000+201    0.6530036101E-02    0.7180632690E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3874086331     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.76620E-04 d,cutoff=     3.3339         3.3508     max grad=    0.65299E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133313129        0.1649780596E-01
 intlbfgs> Highest QCI image energy=    0.8255194307E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8255194307E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    509   -0.1000000000+201    0.7661952537E-04   -0.1000000000+201    0.6529851544E-02    0.3102315226E-05        15     3
 intlbfgs> Mean deviation     0.1649780596E-01 Decreasing QCI force constant to      1.087279323    
 intlbfgs> largest atomic distance between images is     0.3874086296     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.76619E-04 d,cutoff=     3.3339         3.3508     max grad=    0.65298E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133313130        0.1649822100E-01
 intlbfgs> Highest QCI image energy=    0.8255179577E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8255179577E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    510   -0.1000000000+201    0.7661944848E-04   -0.1000000000+201    0.6529848470E-02    0.1654504968E-06        15     3
 intlbfgs> largest atomic distance between images is     0.3874074201     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.76635E-04 d,cutoff=     3.3339         3.3508     max grad=    0.65305E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133313153        0.1660412277E-01
 intlbfgs> Highest QCI image energy=    0.8255028415E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8255028415E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    511   -0.1000000000+201    0.7663465189E-04   -0.1000000000+201    0.6530531633E-02    0.4526380601E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3874086222     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.76620E-04 d,cutoff=     3.3339         3.3508     max grad=    0.65299E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133313129        0.1649876574E-01
 intlbfgs> Highest QCI image energy=    0.8255191700E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8255191700E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    512   -0.1000000000+201    0.7661963376E-04   -0.1000000000+201    0.6529857517E-02    0.4499752795E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3874086231     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.76619E-04 d,cutoff=     3.3339         3.3508     max grad=    0.65299E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133313130        0.1649876093E-01
 intlbfgs> Highest QCI image energy=    0.8255178715E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8255178715E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    513   -0.1000000000+201    0.7661949349E-04   -0.1000000000+201    0.6529852837E-02    0.2165954973E-07        15     3
 intlbfgs> largest atomic distance between images is     0.3874101131     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.76414E-04 d,cutoff=     3.3339         3.3508     max grad=    0.65219E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133314446        0.1651663495E-01
 intlbfgs> Highest QCI image energy=    0.8234615344E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8234615344E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    514   -0.1000000000+201    0.7641372841E-04   -0.1000000000+201    0.6521866261E-02    0.2029288883E-04        15     3
 intlbfgs> Mean deviation     0.1651663495E-01 Decreasing QCI force constant to      1.076514181    
 intlbfgs> largest atomic distance between images is     0.3874123237     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.76121E-04 d,cutoff=     3.3339         3.3508     max grad=    0.65086E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133316567        0.1660551763E-01
 intlbfgs> Highest QCI image energy=    0.8201576486E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8201576486E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    515   -0.1000000000+201    0.7612123024E-04   -0.1000000000+201    0.6508569761E-02    0.2823404895E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3874156804     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.75703E-04 d,cutoff=     3.3340         3.3508     max grad=    0.64928E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133319184        0.1658826891E-01
 intlbfgs> Highest QCI image energy=    0.8161451338E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8161451338E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    516   -0.1000000000+201    0.7570258263E-04   -0.1000000000+201    0.6492843448E-02    0.5573252573E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3874198179     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.75232E-04 d,cutoff=     3.3340         3.3508     max grad=    0.64678E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133323055        0.1681265806E-01
 intlbfgs> Highest QCI image energy=    0.8101979857E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8101979857E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    517   -0.1000000000+201    0.7523226076E-04   -0.1000000000+201    0.6467786764E-02    0.8482205559E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3874155392     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.75663E-04 d,cutoff=     3.3340         3.3508     max grad=    0.64890E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133319786        0.1671684269E-01
 intlbfgs> Highest QCI image energy=    0.8151850432E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8151850432E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    518   -0.1000000000+201    0.7566275412E-04   -0.1000000000+201    0.6488962907E-02    0.4708655656E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3874159462     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.75621E-04 d,cutoff=     3.3340         3.3508     max grad=    0.64872E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133320052        0.1671732395E-01
 intlbfgs> Highest QCI image energy=    0.8147756997E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8147756997E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    519   -0.1000000000+201    0.7562135502E-04   -0.1000000000+201    0.6487240354E-02    0.4386800905E-05        15     3
 intlbfgs> Mean deviation     0.1671732395E-01 Decreasing QCI force constant to      1.065855625    
 intlbfgs> largest atomic distance between images is     0.3874159076     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.75620E-04 d,cutoff=     3.3340         3.3508     max grad=    0.64872E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133320062        0.1672044183E-01
 intlbfgs> Highest QCI image energy=    0.8147604001E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8147604001E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    520   -0.1000000000+201    0.7562034612E-04   -0.1000000000+201    0.6487225178E-02    0.1178774709E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3874105041     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.75635E-04 d,cutoff=     3.3340         3.3508     max grad=    0.64912E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133320400        0.1704494803E-01
 intlbfgs> Highest QCI image energy=    0.8144320201E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8144320201E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    521   -0.1000000000+201    0.7563507164E-04   -0.1000000000+201    0.6491154312E-02    0.1313057875E-03        15     3
 intlbfgs> largest atomic distance between images is     0.3874158660     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.75621E-04 d,cutoff=     3.3340         3.3508     max grad=    0.64873E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133320057        0.1672305950E-01
 intlbfgs> Highest QCI image energy=    0.8147689226E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8147689226E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    522   -0.1000000000+201    0.7562121660E-04   -0.1000000000+201    0.6487283723E-02    0.1300476284E-03        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3874158795     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.75620E-04 d,cutoff=     3.3340         3.3508     max grad=    0.64872E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133320064        0.1672341759E-01
 intlbfgs> Highest QCI image energy=    0.8147573314E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8147573314E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    523   -0.1000000000+201    0.7562006862E-04   -0.1000000000+201    0.6487225486E-02    0.1704017921E-06        15     3
 intlbfgs> largest atomic distance between images is     0.3874179843     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.75401E-04 d,cutoff=     3.3340         3.3508     max grad=    0.64770E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133321569        0.1677740059E-01
 intlbfgs> Highest QCI image energy=    0.8124525415E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8124525415E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    524   -0.1000000000+201    0.7540068533E-04   -0.1000000000+201    0.6476999256E-02    0.2144020767E-04        15     3
 intlbfgs> Mean deviation     0.1677740059E-01 Decreasing QCI force constant to      1.055302599    
 intlbfgs> largest atomic distance between images is     0.3874196516     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.75118E-04 d,cutoff=     3.3341         3.3508     max grad=    0.64656E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133323600        0.1682858847E-01
 intlbfgs> Highest QCI image energy=    0.8093520890E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8093520890E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    525   -0.1000000000+201    0.7511774941E-04   -0.1000000000+201    0.6465642082E-02    0.2621632440E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3874230160     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.74910E-04 d,cutoff=     3.3341         3.3508     max grad=    0.64536E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133324942        0.1690192473E-01
 intlbfgs> Highest QCI image energy=    0.8073550079E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8073550079E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    526   -0.1000000000+201    0.7491038257E-04   -0.1000000000+201    0.6453554849E-02    0.4978588551E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3874250883     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.74410E-04 d,cutoff=     3.3341         3.3508     max grad=    0.64352E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133328650        0.1695832226E-01
 intlbfgs> Highest QCI image energy=    0.8017266985E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8017266985E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    527   -0.1000000000+201    0.7441014209E-04   -0.1000000000+201    0.6435173180E-02    0.6606602369E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3874230973     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.74641E-04 d,cutoff=     3.3341         3.3508     max grad=    0.64452E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133326988        0.1693569565E-01
 intlbfgs> Highest QCI image energy=    0.8042234027E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8042234027E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    528   -0.1000000000+201    0.7464079166E-04   -0.1000000000+201    0.6445235748E-02    0.1978518356E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3874232896     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.74621E-04 d,cutoff=     3.3341         3.3508     max grad=    0.64443E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133327136        0.1694303080E-01
 intlbfgs> Highest QCI image energy=    0.8040009232E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8040009232E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    529   -0.1000000000+201    0.7462058441E-04   -0.1000000000+201    0.6444253778E-02    0.2379816370E-05        15     3
 intlbfgs> Mean deviation     0.1694303080E-01 Decreasing QCI force constant to      1.044854058    
 intlbfgs> largest atomic distance between images is     0.3874232609     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.74621E-04 d,cutoff=     3.3341         3.3508     max grad=    0.64443E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133327135        0.1694383980E-01
 intlbfgs> Highest QCI image energy=    0.8040022802E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8040022802E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    530   -0.1000000000+201    0.7462075940E-04   -0.1000000000+201    0.6444294796E-02    0.3577677727E-06        15     3
 intlbfgs> largest atomic distance between images is     0.3874018541     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.74630E-04 d,cutoff=     3.3341         3.3508     max grad=    0.64707E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133327894        0.1760316407E-01
 intlbfgs> Highest QCI image energy=    0.8041317718E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8041317718E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    531   -0.1000000000+201    0.7463021250E-04   -0.1000000000+201    0.6470718809E-02    0.2791070006E-03        15     3
 intlbfgs> largest atomic distance between images is     0.3874232285     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.74621E-04 d,cutoff=     3.3341         3.3508     max grad=    0.64443E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133327136        0.1694505435E-01
 intlbfgs> Highest QCI image energy=    0.8039999669E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8039999669E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    532   -0.1000000000+201    0.7462066372E-04   -0.1000000000+201    0.6444328257E-02    0.2786567047E-03        15     3
 intlbfgs> largest atomic distance between images is     0.3874232302     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.74620E-04 d,cutoff=     3.3341         3.3508     max grad=    0.64443E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133327137        0.1694509704E-01
 intlbfgs> Highest QCI image energy=    0.8039981783E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8039981783E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    533   -0.1000000000+201    0.7462048799E-04   -0.1000000000+201    0.6444320162E-02    0.2026649095E-07        15     3
 intlbfgs> largest atomic distance between images is     0.3874264567     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.74247E-04 d,cutoff=     3.3341         3.3508     max grad=    0.64276E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133329792        0.1702795083E-01
 intlbfgs> Highest QCI image energy=    0.8000175210E-04 images=       1
 intlbfgs> Highest image        2 energy     0.8000175210E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    534   -0.1000000000+201    0.7424658496E-04   -0.1000000000+201    0.6427563631E-02    0.3336305238E-04        15     3
 intlbfgs> Mean deviation     0.1702795083E-01 Decreasing QCI force constant to      1.034508968    
 intlbfgs> largest atomic distance between images is     0.3874269589     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.74127E-04 d,cutoff=     3.3342         3.3508     max grad=    0.64229E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133330679        0.1705414340E-01
 intlbfgs> Highest QCI image energy=    0.7986901156E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7986901156E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    535   -0.1000000000+201    0.7412747694E-04   -0.1000000000+201    0.6422934273E-02    0.1559637114E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3874286756     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.74084E-04 d,cutoff=     3.3342         3.3508     max grad=    0.64192E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133330899        0.1706310186E-01
 intlbfgs> Highest QCI image energy=    0.7983840422E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7983840422E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    536   -0.1000000000+201    0.7408356234E-04   -0.1000000000+201    0.6419164314E-02    0.4138143096E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3874276253     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.74039E-04 d,cutoff=     3.3342         3.3508     max grad=    0.64191E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133331305        0.1707339312E-01
 intlbfgs> Highest QCI image energy=    0.7977579798E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7977579798E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    537   -0.1000000000+201    0.7403935424E-04   -0.1000000000+201    0.6419130696E-02    0.4016145294E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3874280052     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.73954E-04 d,cutoff=     3.3342         3.3508     max grad=    0.64157E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133331949        0.1709420401E-01
 intlbfgs> Highest QCI image energy=    0.7968001542E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7968001542E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    538   -0.1000000000+201    0.7395367901E-04   -0.1000000000+201    0.6415749058E-02    0.1011872710E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3874297230     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.73699E-04 d,cutoff=     3.3342         3.3508     max grad=    0.64049E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133333811        0.1715525169E-01
 intlbfgs> Highest QCI image energy=    0.7940394823E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7940394823E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    539   -0.1000000000+201    0.7369908100E-04   -0.1000000000+201    0.6404926339E-02    0.2149420847E-04        15     3
 intlbfgs> Mean deviation     0.1715525169E-01 Decreasing QCI force constant to      1.024266305    
 intlbfgs> largest atomic distance between images is     0.3874306356     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.73622E-04 d,cutoff=     3.3342         3.3508     max grad=    0.64011E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133334345        0.1717005742E-01
 intlbfgs> Highest QCI image energy=    0.7932499312E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7932499312E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    540   -0.1000000000+201    0.7362208498E-04   -0.1000000000+201    0.6401139645E-02    0.1039841083E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3874297902     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.73602E-04 d,cutoff=     3.3342         3.3508     max grad=    0.64016E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133334570        0.1718188212E-01
 intlbfgs> Highest QCI image energy=    0.7929255767E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7929255767E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    541   -0.1000000000+201    0.7360237204E-04   -0.1000000000+201    0.6401586000E-02    0.2554331018E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3874312992     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.73532E-04 d,cutoff=     3.3342         3.3508     max grad=    0.63972E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133335000        0.1718835106E-01
 intlbfgs> Highest QCI image energy=    0.7922848185E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7922848185E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    542   -0.1000000000+201    0.7353205826E-04   -0.1000000000+201    0.6397228188E-02    0.2110278845E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3874327142     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.73413E-04 d,cutoff=     3.3342         3.3508     max grad=    0.63914E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133335844        0.1720565156E-01
 intlbfgs> Highest QCI image energy=    0.7910430108E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7910430108E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    543   -0.1000000000+201    0.7341254261E-04   -0.1000000000+201    0.6391399187E-02    0.1428326030E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3874343215     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.73206E-04 d,cutoff=     3.3343         3.3508     max grad=    0.63823E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133337353        0.1725298591E-01
 intlbfgs> Highest QCI image energy=    0.7888290827E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7888290827E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    544   -0.1000000000+201    0.7320566328E-04   -0.1000000000+201    0.6382338258E-02    0.1728866147E-04        15     3
 intlbfgs> Mean deviation     0.1725298591E-01 Decreasing QCI force constant to      1.014125055    
 intlbfgs> largest atomic distance between images is     0.3874344121     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.73123E-04 d,cutoff=     3.3343         3.3508     max grad=    0.63794E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133338003        0.1727980343E-01
 intlbfgs> Highest QCI image energy=    0.7878763207E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7878763207E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    545   -0.1000000000+201    0.7312281823E-04   -0.1000000000+201    0.6379400449E-02    0.1126386526E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3874362114     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.73075E-04 d,cutoff=     3.3343         3.3508     max grad=    0.63755E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133338241        0.1727142352E-01
 intlbfgs> Highest QCI image energy=    0.7875377672E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7875377672E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    546   -0.1000000000+201    0.7307536691E-04   -0.1000000000+201    0.6375507727E-02    0.2684419659E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3874354071     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.72990E-04 d,cutoff=     3.3343         3.3508     max grad=    0.63737E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133338981        0.1731158332E-01
 intlbfgs> Highest QCI image energy=    0.7864499470E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7864499470E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    547   -0.1000000000+201    0.7299030792E-04   -0.1000000000+201    0.6373676924E-02    0.2426934963E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3874355217     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.72904E-04 d,cutoff=     3.3343         3.3508     max grad=    0.63705E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133339646        0.1734608664E-01
 intlbfgs> Highest QCI image energy=    0.7854818819E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7854818819E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    548   -0.1000000000+201    0.7290411118E-04   -0.1000000000+201    0.6370523083E-02    0.9862352225E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3874366725     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.72712E-04 d,cutoff=     3.3343         3.3508     max grad=    0.63624E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133341092        0.1740092245E-01
 intlbfgs> Highest QCI image energy=    0.7833805242E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7833805242E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    549   -0.1000000000+201    0.7271176483E-04   -0.1000000000+201    0.6362387090E-02    0.1785269334E-04        15     3
 intlbfgs> Mean deviation     0.1740092245E-01 Decreasing QCI force constant to      1.004084213    
 intlbfgs> largest atomic distance between images is     0.3874380722     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.72622E-04 d,cutoff=     3.3343         3.3508     max grad=    0.63576E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133341712        0.1740006034E-01
 intlbfgs> Highest QCI image energy=    0.7824818246E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7824818246E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    550   -0.1000000000+201    0.7262199703E-04   -0.1000000000+201    0.6357622204E-02    0.1174668303E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3874430707     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.72508E-04 d,cutoff=     3.3343         3.3508     max grad=    0.63479E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133342302        0.1730920607E-01
 intlbfgs> Highest QCI image energy=    0.7816733641E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7816733641E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    551   -0.1000000000+201    0.7250791778E-04   -0.1000000000+201    0.6347858606E-02    0.5124287749E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3874383259     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.72616E-04 d,cutoff=     3.3343         3.3508     max grad=    0.63571E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133341737        0.1739683423E-01
 intlbfgs> Highest QCI image energy=    0.7824454523E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7824454523E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    552   -0.1000000000+201    0.7261614552E-04   -0.1000000000+201    0.6357061911E-02    0.4808391225E-04        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3874382608     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.72605E-04 d,cutoff=     3.3343         3.3508     max grad=    0.63567E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133341826        0.1740533030E-01
 intlbfgs> Highest QCI image energy=    0.7823167833E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7823167833E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    553   -0.1000000000+201    0.7260458144E-04   -0.1000000000+201    0.6356731659E-02    0.2538838571E-05        15     3
 intlbfgs> largest atomic distance between images is     0.3874390008     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.72363E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63473E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133343666        0.1750638812E-01
 intlbfgs> Highest QCI image energy=    0.7796612327E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7796612327E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    554   -0.1000000000+201    0.7236322170E-04   -0.1000000000+201    0.6347315168E-02    0.2513899745E-04        15     3
 intlbfgs> Mean deviation     0.1750638812E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874418504     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.72129E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63359E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133345401        0.1751051109E-01
 intlbfgs> Highest QCI image energy=    0.7771683368E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7771683368E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    555   -0.1000000000+201    0.7212898440E-04   -0.1000000000+201    0.6335949770E-02    0.2192215555E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3874514135     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71031E-04 d,cutoff=     3.3345         3.3508     max grad=    0.62865E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133353647        0.1770682473E-01
 intlbfgs> Highest QCI image energy=    0.7654813742E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7654813742E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    556   -0.1000000000+201    0.7103145495E-04   -0.1000000000+201    0.6286483173E-02    0.9226917763E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3874435046     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71922E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63268E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346953        0.1755148972E-01
 intlbfgs> Highest QCI image energy=    0.7749482505E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749482505E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    557   -0.1000000000+201    0.7192159244E-04   -0.1000000000+201    0.6326810075E-02    0.7508636899E-04        15     3
 intlbfgs> largest atomic distance between images is     0.3874434421     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71921E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346959        0.1755450187E-01
 intlbfgs> Highest QCI image energy=    0.7749396030E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749396030E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    558   -0.1000000000+201    0.7192084466E-04   -0.1000000000+201    0.6326850577E-02    0.5847017543E-06        15     3
 intlbfgs> largest atomic distance between images is     0.3874434100     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71921E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755615503E-01
 intlbfgs> Highest QCI image energy=    0.7749335800E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335800E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    559   -0.1000000000+201    0.7192050518E-04   -0.1000000000+201    0.6326868464E-02    0.3130512477E-06        15     3
 intlbfgs> Mean deviation     0.1755615503E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434097     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619345E-01
 intlbfgs> Highest QCI image energy=    0.7749335651E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335651E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    560   -0.1000000000+201    0.7192048356E-04   -0.1000000000+201    0.6326868112E-02    0.1052352764E-07        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619323E-01
 intlbfgs> Highest QCI image energy=    0.7749335400E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335400E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    561   -0.1000000000+201    0.7192048408E-04   -0.1000000000+201    0.6326867996E-02    0.3387748865E-08        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619331E-01
 intlbfgs> Highest QCI image energy=    0.7749335402E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335402E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    562   -0.1000000000+201    0.7192048487E-04   -0.1000000000+201    0.6326868006E-02    0.4861787628E-09        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619326E-01
 intlbfgs> Highest QCI image energy=    0.7749335392E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335392E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    563   -0.1000000000+201    0.7192048473E-04   -0.1000000000+201    0.6326868000E-02    0.2397821677E-10        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    564   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4058789103E-11        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    565   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3996417382E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    566   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8530281928E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    567   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1267755577E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    568   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9347848195E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    569   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4651809224E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    570   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1168684935E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    571   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6991084967E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    572   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4125623138E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    573   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3389237210E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    574   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9017573322E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    575   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4022173641E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    576   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1793719365E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    577   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1725131442E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    578   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8112339985E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    579   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2573743828E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    580   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2425937046E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    581   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2361103125E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    582   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7085189135E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    583   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4083600124E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    584   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3213688507E-14        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    585   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2726610921E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    586   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7144076045E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    587   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3273272998E-15        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    588   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2590592339E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    589   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2531296513E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    590   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5322471438E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    591   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4379025981E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    592   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7640330699E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    593   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3028797106E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    594   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1000584527E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    595   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9310796410E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    596   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7774790373E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    597   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3126693339E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    598   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4810938507E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    599   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4740480474E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 checkrep> number of active repulsions and total=      69      69
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    600   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6100822202E-15        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    601   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2291851917E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    602   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2227797500E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    603   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7618451762E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    604   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3053158433E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    605   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2890194948E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    606   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2822518319E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    607   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7901532199E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    608   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3221997498E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    609   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3067778572E-12        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    610   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3060956622E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    611   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6424244412E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    612   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7086603093E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    613   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3846613974E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    614   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1109572556E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    615   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1038421555E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    616   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5627185756E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    617   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1537341538E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    618   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9270547704E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    619   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3615910304E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619326E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    620   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1436217388E-11        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    621   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1433885998E-11        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619338E-01
 intlbfgs> Highest QCI image energy=    0.7749335398E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335398E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    622   -0.1000000000+201    0.7192048480E-04   -0.1000000000+201    0.6326868004E-02    0.1064316791E-10        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    623   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1061122599E-10        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    624   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6365638843E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    625   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1171862706E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    626   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7227762474E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    627   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8052586728E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    628   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4579599598E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    629   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2895035445E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    630   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2824447242E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    631   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5778967572E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    632   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7234476935E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    633   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6601028884E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    634   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7434563238E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    635   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6131564329E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    636   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3568986230E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    637   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8974608988E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    638   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8261610507E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    639   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9731781092E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    640   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3904258067E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    641   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7323410136E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    642   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7251200805E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    643   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1280361918E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    644   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7575829239E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    645   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8419870783E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    646   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5065074344E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    647   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4112938330E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    648   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3396021412E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    649   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6536277895E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    650   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1709867530E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    651   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1010353855E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    652   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3964723716E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    653   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1147688288E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    654   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1141269461E-12        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    655   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7977686492E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    656   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5686209960E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    657   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6246896986E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    658   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4788887643E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    659   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5314785776E-14        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    660   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4687135935E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    661   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6960596672E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    662   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7417410183E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    663   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4653160072E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    664   -0.1000000000+201    0.7192048474E-04   -0.1000000000+201    0.6326868001E-02    0.6065295985E-12        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    665   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6057864121E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    666   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7178075555E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    667   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3091107418E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    668   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8392814695E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    669   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8327202336E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    670   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7128916030E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    671   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3844197325E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    672   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1029358048E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    673   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9763099845E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    674   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5654872838E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    675   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3552080173E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    676   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2992791396E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    677   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1036281327E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    678   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3546111986E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    679   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5787528157E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    680   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5724965872E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    681   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6988639815E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    682   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1165664239E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    683   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7042946045E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    684   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5813400122E-14        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    685   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5110321806E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    686   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5822646785E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    687   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8292521007E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    688   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7630785964E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    689   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8197166400E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    690   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3368791271E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    691   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1605199959E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    692   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1540937542E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    693   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6024907643E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    694   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2035741849E-14        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    695   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1499283196E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    696   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9271016118E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    697   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3962065405E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    698   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2773373486E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    699   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2207712090E-14        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 checkrep> number of active repulsions and total=      69      69
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    700   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9950649998E-15        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    701   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4249604209E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    702   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3733347750E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    703   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3668838988E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    704   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6443203118E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    705   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1331659336E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    706   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7803434096E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    707   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4683320127E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    708   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7869551838E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    709   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3795636197E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    710   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9862681120E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    711   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9199213395E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    712   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6349163664E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    713   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1459994062E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    714   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8896360118E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    715   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5156783360E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    716   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2633927511E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    717   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2123142353E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    718   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9490526922E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    719   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3845611948E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    720   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1355073165E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    721   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1287865626E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    722   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6445656596E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    723   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9599080845E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    724   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5918284010E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    725   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4537064977E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    726   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3849474221E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    727   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7038483651E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    728   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2312366840E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    729   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1734426454E-14        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    730   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8825704345E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    731   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3452042830E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    732   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1258906551E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    733   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1252222572E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    734   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7768726721E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    735   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3265528991E-15        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    736   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1338436233E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    737   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5318131924E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    738   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1335515237E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    739   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1330935265E-12        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    740   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5996699462E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    741   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8863279602E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    742   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1821548240E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    743   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1010129948E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    744   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4763352687E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    745   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9152357382E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    746   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4984855237E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    747   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5462664346E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    748   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5387170998E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    749   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6448052888E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    750   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3474301334E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    751   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2910248614E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    752   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8461761285E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    753   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3278854821E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    754   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4152612906E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    755   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4089593901E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    756   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6660809012E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    757   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1855765569E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    758   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1339101249E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    759   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7636995147E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    760   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4412569205E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    761   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3170963375E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    762   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3115316722E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    763   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6989993648E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    764   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4592197793E-14        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    765   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3948052984E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    766   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5738598614E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    767   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9002151556E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    768   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8392899515E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    769   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7064033103E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    770   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6772651237E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    771   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3326008734E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    772   -0.1000000000+201    0.7192048474E-04   -0.1000000000+201    0.6326868001E-02    0.1800862007E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    773   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1793988226E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    774   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6863199889E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    775   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1116243915E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    776   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6492985215E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    777   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1692469787E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    778   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8970478379E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    779   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3713842055E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    780   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1057713613E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    781   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9960937729E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    782   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7700441994E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    783   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3319695585E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    784   -0.1000000000+201    0.7192048474E-04   -0.1000000000+201    0.6326868001E-02    0.1315929109E-11        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    785   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1315235474E-11        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    786   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7588807195E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    787   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7729919218E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    788   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4346919615E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    789   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9381590660E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    790   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9310055334E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    791   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6516908089E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    792   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3098919523E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    793   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2449761915E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    794   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5161478976E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    795   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1383183031E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    796   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1320402887E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    797   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9209278361E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    798   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3613177175E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    799   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1072517342E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 checkrep> number of active repulsions and total=      69      69
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    800   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1007296184E-13        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    801   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7228157348E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    802   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5959715107E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    803   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3465990601E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    804   -0.1000000000+201    0.7192048474E-04   -0.1000000000+201    0.6326868001E-02    0.9707168511E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    805   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9645317784E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    806   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1030726101E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    807   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4993212274E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    808   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1204251483E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    809   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1129977087E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    810   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7376380751E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    811   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3013988642E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    812   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3992850821E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    813   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3922008264E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    814   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6931368863E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    815   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1894210176E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    816   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1408263645E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    817   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8907167217E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    818   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3808878404E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    819   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4041407154E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    820   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3972678481E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    821   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7982791266E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    822   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3342589341E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    823   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5613227749E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    824   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5541632227E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    825   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6971458970E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    826   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8215601281E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    827   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4479308785E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    828   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6197472408E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    829   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6124929041E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    830   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6167569663E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    831   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1174744059E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    832   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1108517842E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    833   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6468344300E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    834   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6629233357E-14        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    835   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6006636801E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    836   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6088986470E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    837   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3893092981E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    838   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3318396267E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    839   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1067077842E-14        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    840   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4682546419E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    841   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3362342802E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    842   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2626301974E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    843   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5871769748E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    844   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1220582111E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    845   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1154409040E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    846   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8880965037E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    847   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3819239030E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    848   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4054573067E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    849   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3989797698E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    850   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7366154967E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    851   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3017538405E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    852   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1480564176E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    853   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1473820689E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    854   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6232188595E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    855   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2204083033E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    856   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1638245387E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    857   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5237421678E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    858   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1753390363E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    859   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1063905139E-14        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    860   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4495597754E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    861   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6223714296E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    862   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6159008540E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    863   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9045919876E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    864   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4037016412E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    865   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8073279914E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    866   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8066250418E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    867   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6778641491E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    868   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3442599869E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    869   -0.1000000000+201    0.7192048474E-04   -0.1000000000+201    0.6326868001E-02    0.1237601904E-12        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    870   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1232519738E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    871   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5766442740E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    872   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2583788617E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    873   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2518863594E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    874   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7730606582E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    875   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7188878163E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    876   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4351406735E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    877   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1656512468E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    878   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1586734890E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    879   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6796896770E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    880   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1645331646E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    881   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9825801842E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    882   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4049267502E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    883   -0.1000000000+201    0.7192048474E-04   -0.1000000000+201    0.6326868001E-02    0.2428660123E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    884   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2421625473E-12        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    885   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8036138076E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    886   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3434599194E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    887   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1870944477E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    888   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1864382120E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    889   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7222008082E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    890   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1035452640E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    891   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6095983897E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    892   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1998066678E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    893   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1380004781E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    894   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7481412706E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    895   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3846185253E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619328E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    896   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1030074466E-11        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    897   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1029445015E-11        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    898   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6349002869E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    899   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7590125062E-14        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 checkrep> number of active repulsions and total=      69      69
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    900   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6963040290E-14        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    901   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6349344644E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    902   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2284670168E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    903   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1794609858E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    904   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1146026478E-14        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    905   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5291085898E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    906   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5420128951E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    907   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4755889287E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    908   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8165406621E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    909   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3211211288E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    910   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8453079312E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    911   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8388258259E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    912   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7348871819E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    913   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2934939796E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    914   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1328515107E-12        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    915   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1321468063E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    916   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7055062184E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    917   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8093515946E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    918   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4171432568E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    919   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2700488894E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    920   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2637189192E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    921   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7316731337E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    922   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3322527032E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    923   -0.1000000000+201    0.7192048474E-04   -0.1000000000+201    0.6326868001E-02    0.3050755454E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    924   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3043912752E-12        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    925   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7880751685E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    926   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2722121233E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    927   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2032286046E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    928   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1963170582E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    929   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6146442577E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    930   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5973964501E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    931   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5342480686E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    932   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7124011719E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    933   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5619242570E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    934   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3499031687E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    935   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9601623625E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    936   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8929026121E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    937   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6899730904E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    938   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9605604650E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    939   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6059314554E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    940   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1260284812E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    941   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1181967184E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    942   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6213319376E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    943   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1138564135E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    944   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6966282048E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    945   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1567897484E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    946   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8494161493E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    947   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2795620603E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619330E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    948   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1243919113E-11        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    949   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1243204068E-11        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    950   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7962353844E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    951   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2878980161E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    952   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5901815762E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    953   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5832480736E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    954   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7393574012E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    955   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2963953060E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    956   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8438708911E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    957   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8375999773E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    958   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7857792887E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    959   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3419613681E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    960   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4464707143E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    961   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4404307859E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    962   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8448676280E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    963   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3377472471E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    964   -0.1000000000+201    0.7192048474E-04   -0.1000000000+201    0.6326868001E-02    0.4022080249E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    965   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3951764787E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    966   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7906459062E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    967   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3477352145E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    968   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2738848879E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    969   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2670199714E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    970   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6507582245E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    971   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1235929817E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    972   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7331217784E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    973   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1237935819E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    974   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7017722363E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    975   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2586191068E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    976   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9932843274E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    977   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5668893624E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    978   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1116394699E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    979   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5765724904E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    980   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1512773338E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    981   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9087573759E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    982   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3415033481E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619332E-01
 intlbfgs> Highest QCI image energy=    0.7749335395E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335395E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    983   -0.1000000000+201    0.7192048477E-04   -0.1000000000+201    0.6326868002E-02    0.3781601983E-11        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    984   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3780814613E-11        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    985   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6121259318E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    986   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1356810342E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    987   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8007166100E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    988   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6392425730E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    989   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3933528272E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    990   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3846992950E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    991   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3840454114E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    992   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8597294561E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    993   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2790488782E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    994   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2211633357E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    995   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2146168306E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    996   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6859442157E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    997   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1381683086E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    998   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8111022662E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:    999   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5520212422E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 checkrep> number of active repulsions and total=      69      69
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1000   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8392064913E-15        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1001   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7738451537E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1002   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5968911113E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1003   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1018679937E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1004   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5745366397E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1005   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6484138455E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1006   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5806267830E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1007   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6043629038E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1008   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4428129324E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1009   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4357748849E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1010   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6432900591E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1011   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6663480030E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1012   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3384908277E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1013   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2679621834E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1014   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2609755837E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1015   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6439621470E-15        15     3
 intlbfgs> Allowing   1000 further optimization steps
 intlbfgs> extra distance before turning on constraint potential is now     0.050000
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1016   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6583013848E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1017   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3373796783E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1018   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5131043026E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1019   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5062787080E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1020   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6898889951E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1021   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1105979409E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1022   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6631534031E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1023   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3616595764E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1024   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3033940703E-14        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1025   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9526393235E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1026   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4169376502E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1027   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8391544876E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1028   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7713975606E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1029   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6044985762E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1030   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1043799488E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1031   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5925205094E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619325E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1032   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1224455210E-11        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1033   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1223740597E-11        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1034   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8357720511E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1035   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3644103405E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1036   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2847078550E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1037   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2783542354E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1038   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8158624149E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1039   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3066394392E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1040   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3813020626E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1041   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3743606713E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1042   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7534413012E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1043   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7157518025E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1044   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3872889805E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1045   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3673766724E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1046   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3606787742E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1047   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7412657612E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1048   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3126665093E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1049   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9682469981E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1050   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9613898564E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1051   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8914619660E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1052   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3821378220E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1053   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4401672172E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1054   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4335567934E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1055   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7241406727E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1056   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7015470024E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1057   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3328028669E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1058   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1872146321E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1059   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1809756157E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1060   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7797041348E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1061   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2597100744E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1062   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2447756273E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1063   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2382050558E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1064   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8220131299E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1065   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1004156941E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1066   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5804422626E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1067   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1055667659E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1068   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1048190171E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1069   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7784913084E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1070   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3046720854E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1071   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2438045577E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1072   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2431558828E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1073   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7366859341E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1074   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3023816616E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1075   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1242934712E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1076   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1235935014E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1077   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7636248756E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1078   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3024816371E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1079   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4060449609E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1080   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3990847832E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1081   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7832692484E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1082   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3161043181E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1083   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4488336119E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1084   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4419401149E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1085   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7115410712E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1086   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1271607879E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1087   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6819366670E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1088   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4480509738E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1089   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2345662540E-14        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1090   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1752205672E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1091   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4849700873E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1092   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1412423994E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1093   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1345833797E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1094   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7494034692E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1095   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2940332218E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1096   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8103198185E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1097   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8028830421E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1098   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7900399579E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1099   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3430018357E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 checkrep> number of active repulsions and total=      69      69
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1100   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2476325722E-14        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1101   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1848194415E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1102   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1132838895E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1103   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4463268467E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1104   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7015780708E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1105   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6950068723E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1106   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8569363291E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1107   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7707153996E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1108   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4166667996E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1109   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5793262562E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1110   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5729274399E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1111   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6507794947E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1112   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2890521920E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1113   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2225722833E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1114   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5807188116E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1115   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1418946777E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1116   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8297740884E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1117   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3464992099E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1118   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2533534926E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1119   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1956672176E-14        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1120   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1121288846E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1121   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5240849707E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1122   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1891183528E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1123   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1080700461E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1124   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7457268751E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1125   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6533581563E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1126   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4076777090E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1127   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1191700455E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1128   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1123641276E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1129   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7041292392E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1130   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1394339381E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1131   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7557910059E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1132   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2247689335E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1133   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1601247989E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1134   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8208481544E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1135   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3659232066E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1136   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1426003930E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1137   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1419389063E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1138   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8831196706E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1139   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3939056657E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1140   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5874008464E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1141   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5210974935E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1142   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5934777028E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1143   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1537032639E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1144   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1530337886E-12        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1145   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7020295939E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1146   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3705496409E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1147   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2309249064E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1148   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2249568939E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1149   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7067360558E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1150   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2996488247E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1151   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2290118783E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1152   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5353708898E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1153   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4759765263E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1154   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4694141864E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1155   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7532798809E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1156   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2146952187E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1157   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1645126648E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1158   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1048637309E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1159   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4737446004E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1160   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4293059287E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1161   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3629922032E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1162   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5635512377E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1163   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1566800097E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1164   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1502201101E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1165   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7000704493E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1166   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3047709808E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1167   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9248060865E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1168   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5646635409E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1169   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1100460673E-14        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1170   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5905562025E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1171   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4615344065E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1172   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3914182132E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1173   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5964310626E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1174   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4113998032E-14        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1175   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3475447521E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1176   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8394872072E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1177   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3354326113E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1178   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2910753493E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1179   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2904189353E-12        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1180   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6933980028E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1181   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2940168527E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1182   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7250262556E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1183   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7191793464E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1184   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6868445870E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1185   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2811183459E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1186   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2127762098E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1187   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5147109448E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1188   -0.1000000000+201    0.7192048474E-04   -0.1000000000+201    0.6326868001E-02    0.3628104282E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1189   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3621624952E-12        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1190   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8081680024E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1191   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2863162895E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1192   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4389534642E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1193   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4323527487E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1194   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8836155297E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1195   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4369394252E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1196   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4348287861E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1197   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4271847669E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1198   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7214646319E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1199   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2813126147E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 checkrep> number of active repulsions and total=      69      69
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1200   -0.1000000000+201    0.7192048474E-04   -0.1000000000+201    0.6326868001E-02    0.2417630419E-12        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1201   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2411113616E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1202   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8580821818E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1203   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4086380950E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1204   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6362888476E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1205   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6289695011E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1206   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7053185455E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1207   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2625071439E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1208   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1505407234E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1209   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1498858212E-12        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1210   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8487301057E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1211   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3241873514E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1212   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8200164179E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1213   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8135196249E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1214   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7782302539E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1215   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2985866092E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1216   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1564429847E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1217   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1557585554E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1218   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9584217176E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1219   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5023018156E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1220   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7524623027E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1221   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6829664721E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1222   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7892957654E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1223   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3108524173E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1224   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2039521473E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1225   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1970262313E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1226   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7356490384E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1227   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3055295204E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1228   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2742205266E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1229   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2676757222E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1230   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7993860387E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1231   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3001992704E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1232   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7944789224E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1233   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7292181375E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1234   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7743707892E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1235   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3396315553E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1236   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8243667953E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1237   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8180188245E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1238   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8137026673E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1239   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3575099496E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1240   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2162453182E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1241   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2092866666E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1242   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7362928125E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1243   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2769851579E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1244   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8857307569E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1245   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8789217169E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1246   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9422025398E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1247   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3961493717E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1248   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2449960371E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1249   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2382085268E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1250   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8403623946E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1251   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3851942939E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1252   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2069655912E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1253   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1997383328E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1254   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7129576478E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1255   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2536381965E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1256   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1920860611E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1257   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1085331735E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1258   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4885006424E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1259   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7885538992E-14        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1260   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7191286749E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1261   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6790477949E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1262   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1907521018E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1263   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1128417135E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1264   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4413324550E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1265   -0.1000000000+201    0.7192048474E-04   -0.1000000000+201    0.6326868001E-02    0.4760512155E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1266   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4753997440E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1267   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7398215326E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1268   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2753473618E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1269   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5056371166E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1270   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4990592413E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1271   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7080252460E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1272   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2786471004E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1273   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9400850665E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1274   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9334283358E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1275   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6967706816E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1276   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2638187495E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1277   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4080168350E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1278   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4016976371E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1279   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7258210596E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1280   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2786533876E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1281   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8703705721E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1282   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5338221401E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1283   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3149226715E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1284   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2423400759E-14        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1285   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7432551517E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1286   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8941952794E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1287   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5176769265E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1288   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1331424195E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1289   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1265352783E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1290   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8656760339E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1291   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3712918909E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1292   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3168067815E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1293   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3098497180E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1294   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6414923834E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619328E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1295   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6432255444E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1296   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6425455031E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1297   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8115260995E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1298   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3098910730E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1299   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4434643526E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 checkrep> number of active repulsions and total=      69      69
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1300   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4369459254E-13        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1301   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7186129596E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1302   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2785243086E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1303   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3867227487E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1304   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3802938202E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1305   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7652707226E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1306   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3369228275E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1307   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4181582997E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1308   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4112260715E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1309   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7293952884E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1310   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3835005772E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1311   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9597661617E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1312   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9538302681E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1313   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7454970196E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1314   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1648847531E-14        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1315   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9943012073E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1316   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3620122365E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1317   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2041152244E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1318   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1971366868E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1319   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9039402470E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1320   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4149017060E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1321   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7690144734E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1322   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6987813232E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1323   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6019274417E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1324   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6489482241E-14        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1325   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5846014818E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1326   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9194531510E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1327   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3426541862E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1328   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1560366228E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1329   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1490179203E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1330   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7533982046E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1331   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3097019974E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1332   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6783662604E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1333   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5849202624E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1334   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5303023238E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1335   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5380757128E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1336   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1435265178E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1337   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8300154544E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1338   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3685869894E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1339   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2342899628E-14        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1340   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1793844353E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1341   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1136235012E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1342   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5549323824E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1343   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2371247068E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1344   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1818463062E-14        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1345   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1057037629E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1346   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4568654731E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1347   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6213392989E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1348   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5571524434E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1349   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8785841969E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1350   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3880741119E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1351   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2858027421E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1352   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2784768330E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1353   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7973396416E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1354   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3436679933E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619328E-01
 intlbfgs> Highest QCI image energy=    0.7749335392E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335392E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1355   -0.1000000000+201    0.7192048474E-04   -0.1000000000+201    0.6326868001E-02    0.2919364053E-11        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1356   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2918714088E-11        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1357   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6869729659E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1358   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5167234326E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1359   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4537889565E-14        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1360   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8807997459E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1361   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3666068083E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1362   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4804486848E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1363   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4740233461E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1364   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7633489313E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1365   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2751913726E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1366   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6437014761E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1367   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6372201093E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1368   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7837623693E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1369   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3104148402E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1370   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5740685889E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1371   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5674324926E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1372   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7939023613E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1373   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3341132414E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1374   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1730814414E-12        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1375   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1724260673E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1376   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7416048808E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1377   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3500244081E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1378   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6172387075E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1379   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6108445744E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1380   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9286312614E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1381   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4031514417E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1382   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2567276697E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1383   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2496267540E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1384   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6857083359E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1385   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2042423515E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1386   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1541331643E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1387   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9136821584E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1388   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3266921169E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619328E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1389   -0.1000000000+201    0.7192048474E-04   -0.1000000000+201    0.6326868001E-02    0.3532988102E-12        15     3
 intlbfgs> Mean deviation     0.1755619328E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1390   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3526419192E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1391   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7486645216E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1392   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3134374129E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1393   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5124793542E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1394   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5058914278E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1395   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6940522786E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1396   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2312705967E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1397   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1753288528E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1398   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9422571568E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1399   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3593179190E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 checkrep> number of active repulsions and total=      69      69
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1400   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9027195632E-14        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1401   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8397447356E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1402   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9679849712E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1403   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4078156183E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1404   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3907350984E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1405   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3838446277E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1406   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8506411260E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1407   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3447049835E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1408   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1123180880E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1409   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1116322804E-12        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1410   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1067943322E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1411   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4722869012E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1412   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3688865700E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1413   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3616047402E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1414   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6774210310E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1415   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2559838729E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1416   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1981700508E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1417   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1218628723E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1418   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5474142381E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1419   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3086028409E-14        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1420   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2430458618E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1421   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6494994506E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1422   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1585981564E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1423   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8754350777E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1424   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4033309592E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1425   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6525683644E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1426   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6457453900E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1427   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6998619056E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1428   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1664645647E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1429   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1595987359E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1430   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7821629240E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1431   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3190037095E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1432   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1951392482E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1433   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1885990363E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1434   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7051415422E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1435   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3001952574E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1436   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2278372011E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1437   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4933427798E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1438   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2433664907E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1439   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2371312743E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1440   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7173354745E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1441   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2959188878E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1442   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5568987090E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1443   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4943069514E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1444   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6893715630E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1445   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6825939621E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1446   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6743412585E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1447   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1544321727E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1448   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8787373401E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1449   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4973606303E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1450   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1471564978E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1451   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9191497957E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1452   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8056303405E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1453   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4167846248E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1454   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3948285751E-12        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1455   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3941947639E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1456   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6728930466E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1457   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1187672292E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1458   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1123099443E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1459   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8230212236E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1460   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3545331638E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1461   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2312047421E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1462   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2243509417E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1463   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7429145126E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1464   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3202607960E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1465   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2433242439E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1466   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2426699138E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1467   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6729868585E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1468   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1940162879E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1469   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1873540541E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1470   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7642851172E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1471   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1430755490E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1472   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8274964383E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1473   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3075459169E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619328E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1474   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8026472812E-12        15     3
 intlbfgs> Mean deviation     0.1755619328E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1475   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8019843918E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1476   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8624430065E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1477   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3612987910E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1478   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4145449672E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1479   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4080553285E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1480   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7240143750E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1481   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3416476873E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1482   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1383273084E-11        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1483   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1382657561E-11        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1484   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7576854041E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1485   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2956414075E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1486   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1430097393E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1487   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1423333224E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1488   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9966978858E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1489   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4995627010E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1490   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2119251650E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1491   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2052143265E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1492   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7677322940E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1493   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3165385713E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1494   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3708083173E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1495   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3640147536E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1496   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7813605038E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1497   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3523041291E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1498   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4832235301E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1499   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4760269748E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 checkrep> number of active repulsions and total=      69      69
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1500   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7391514025E-15        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1501   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2988982968E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1502   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1852366743E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1503   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1845254972E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1504   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8223078640E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1505   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3177702655E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1506   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3571244034E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1507   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3500432704E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1508   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7650841722E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1509   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2893618533E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1510   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2053076277E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1511   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1987671337E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1512   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6779927491E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1513   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2715991349E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1514   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7376765725E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1515   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7311513220E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1516   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7379502514E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1517   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1505339356E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1518   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8709471254E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1519   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3467102996E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1520   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8821125703E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1521   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8813954652E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1522   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9009682773E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1523   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3474812591E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1524   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3075404246E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1525   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3007032862E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1526   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7881311781E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1527   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3687867111E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619317E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1528   -0.1000000000+201    0.7192048476E-04   -0.1000000000+201    0.6326868001E-02    0.1033576629E-10        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1529   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1033513629E-10        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1530   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6726200712E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1531   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3072940474E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1532   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9290448679E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1533   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5684000236E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1534   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1124758819E-14        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1535   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5831584656E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1536   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4392459600E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1537   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4326430712E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1538   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7107194803E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1539   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3074985785E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619329E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1540   -0.1000000000+201    0.7192048474E-04   -0.1000000000+201    0.6326868001E-02    0.1370933602E-11        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1541   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1370286115E-11        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1542   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9365969648E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1543   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4114964888E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1544   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2441969525E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1545   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2375052999E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1546   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7552240099E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1547   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3216676872E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1548   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5174337468E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1549   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2863354330E-14        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1550   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2243529222E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1551   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6032403741E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1552   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3625206496E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1553   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3042182850E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1554   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7164956109E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1555   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3437824125E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1556   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9062108083E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1557   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5003536973E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1558   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1891707151E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1559   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1101240051E-14        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1560   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5260657611E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1561   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1016886420E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1562   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5322121452E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1563   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2979327714E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1564   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2250721489E-14        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1565   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5448800223E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1566   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1093518174E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1567   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6778848394E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1568   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7082447186E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1569   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4108670827E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1570   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3476576779E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1571   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3403942533E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1572   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7644251721E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1573   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2560874868E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1574   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2001416089E-14        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1575   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1080512808E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1576   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4850917406E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1577   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1573309272E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1578   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1503081545E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1579   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7337424094E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1580   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3078142436E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1581   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3283015895E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1582   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3217175662E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1583   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7632547693E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1584   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3112273489E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1585   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1467116104E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1586   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1460287383E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1587   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8113698384E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1588   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3308246250E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1589   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4016091096E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1590   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3951460840E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1591   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8568855069E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1592   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3851862322E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1593   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2723402807E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1594   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2654361985E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1595   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7026231344E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1596   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4109711739E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1597   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3457842054E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1598   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6022681977E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1599   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2004155427E-14        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 checkrep> number of active repulsions and total=      69      69
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1600   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1479220358E-14        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1601   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8746396129E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1602   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3198230528E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1603   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9601076102E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1604   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9535153237E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1605   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1154163459E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1606   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4714594132E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1607   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4844721494E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1608   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4246064457E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1609   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7623400824E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1610   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3532424631E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619328E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1611   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1421130820E-11        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1612   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1420498952E-11        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1613   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8413076641E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1614   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3537830620E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1615   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4140456590E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1616   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4071974912E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1617   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8298981722E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1618   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3247851798E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1619   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1430743262E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1620   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1361963380E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1621   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7642856479E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1622   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1728921286E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1623   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9943153533E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1624   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4389697791E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1625   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1154621372E-11        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1626   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1153919626E-11        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1627   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7951772168E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1628   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3834511329E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1629   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2445329112E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1630   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2370932836E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1631   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7048152153E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1632   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1491335870E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1633   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8854349112E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1634   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3338611078E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619326E-01
 intlbfgs> Highest QCI image energy=    0.7749335392E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335392E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1635   -0.1000000000+201    0.7192048474E-04   -0.1000000000+201    0.6326868001E-02    0.1490208069E-11        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1636   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1489493120E-11        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1637   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8688864739E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1638   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3753273657E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1639   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2399095938E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1640   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2327155112E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1641   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7216848933E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1642   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2866303473E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1643   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2822092474E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1644   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2751891786E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1645   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7129435499E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1646   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1513306552E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1647   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8804375770E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1648   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6232139493E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1649   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6266833347E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1650   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2825217664E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1651   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3779818945E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1652   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3773243698E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1653   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8634405833E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1654   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4988443380E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1655   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1665455845E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1656   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1596402185E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1657   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8392529462E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1658   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3333836776E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1659   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2698082808E-12        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1660   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2691386818E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1661   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8003493565E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1662   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9562520053E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1663   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5495611976E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1664   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2799775524E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1665   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2731240892E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1666   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8188613407E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1667   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9636741117E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1668   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4909341582E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1669   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2272881477E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1670   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2209497332E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1671   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6924848963E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1672   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4641228651E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1673   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3916696011E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1674   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6228413879E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1675   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1853681473E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1676   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1787537855E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1677   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8763998849E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1678   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3726142542E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1679   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8169084793E-14        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1680   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7491264761E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1681   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6886134188E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1682   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1510769427E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1683   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8472724631E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1684   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3353500181E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1685   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5499177630E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1686   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5435434863E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1687   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8336919050E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1688   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7428833723E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1689   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4236219430E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1690   -0.1000000000+201    0.7192048474E-04   -0.1000000000+201    0.6326868001E-02    0.4437822270E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1691   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4431329686E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1692   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7041514461E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1693   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5171935646E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1694   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4550202946E-14        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1695   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7830436958E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1696   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3125612120E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1697   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4252890260E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1698   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4187918188E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1699   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6505389005E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 checkrep> number of active repulsions and total=      69      69
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1700   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2505722121E-15        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1701   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1280863057E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1702   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1274516879E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1703   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7875645128E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1704   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2959011293E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1705   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8933988561E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1706   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8866543979E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1707   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9145899855E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1708   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4091960584E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1709   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7005400978E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1710   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6935115917E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1711   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6791605356E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1712   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3191410118E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1713   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2114047112E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1714   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2108140295E-12        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1715   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6953239502E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1716   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2668597359E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1717   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4445269627E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1718   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4383576776E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1719   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6912704151E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1720   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1989520293E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1721   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1185369941E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1722   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4580448125E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619329E-01
 intlbfgs> Highest QCI image energy=    0.7749335392E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335392E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1723   -0.1000000000+201    0.7192048474E-04   -0.1000000000+201    0.6326868001E-02    0.2669435558E-11        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1724   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2668800436E-11        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1725   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7940767207E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1726   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3077309937E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1727   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3422969909E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1728   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3416353457E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1729   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8130538694E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1730   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6968574979E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1731   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3859857659E-15        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1732   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8303013968E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1733   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9396316621E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1734   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1271183266E-12        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1735   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1214016770E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1736   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8942438287E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1737   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8614418999E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1738   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4761294908E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1739   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4800436144E-14        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1740   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4170594336E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1741   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8153050168E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1742   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3613528317E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1743   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3386661857E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1744   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3318638872E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1745   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8844564639E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1746   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3761437685E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1747   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1078117732E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1748   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1008884742E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1749   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7641613728E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1750   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2947600362E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1751   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2783853879E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1752   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2715433834E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1753   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7025486248E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1754   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3350257034E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1755   -0.1000000000+201    0.7192048474E-04   -0.1000000000+201    0.6326868001E-02    0.3243221914E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1756   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3237379294E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1757   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7925346413E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1758   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3025162779E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1759   -0.1000000000+201    0.7192048474E-04   -0.1000000000+201    0.6326868001E-02    0.2666094876E-12        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1760   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2658738176E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1761   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8683694255E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1762   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3913980312E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1763   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7457859412E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1764   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6817546703E-14        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1765   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7363386511E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1766   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1763386812E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1767   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9740032630E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1768   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3970947931E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1769   -0.1000000000+201    0.7192048474E-04   -0.1000000000+201    0.6326868001E-02    0.4650479506E-12        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1770   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4644022941E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1771   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8033550081E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1772   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3340639346E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1773   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3849751655E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1774   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3785165799E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1775   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7938167078E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1776   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3465094041E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1777   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3248693017E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1778   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3179572916E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1779   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7179970617E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1780   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2939329598E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1781   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4441521811E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1782   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4364414987E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1783   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8976738576E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1784   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4097833841E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1785   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1400380412E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1786   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1327141543E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1787   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8372419583E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1788   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3602965101E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1789   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2821138298E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1790   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2751368593E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1791   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6857611879E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1792   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3292360744E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1793   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1408433189E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1794   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1401830975E-12        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1795   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5912861437E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1796   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1073629294E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1797   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1009654973E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1798   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7450258384E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1799   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3512316804E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 checkrep> number of active repulsions and total=      69      69
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1800   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3762947418E-13        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1801   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3694104267E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1802   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2286113085E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1803   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1639266778E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1804   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8734963557E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1805   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3710797605E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1806   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9849274839E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1807   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9778524819E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1808   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7627377237E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1809   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6295963607E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1810   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3665122632E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1811   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2143968023E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1812   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2137468509E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1813   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7659173175E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1814   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9487174557E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1815   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4763890439E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1816   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4222566339E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1817   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3534080579E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1818   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7447616747E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1819   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1410719771E-14        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1820   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8479193332E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1821   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3437078552E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1822   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2432804456E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1823   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2362620541E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1824   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7130295111E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1825   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2825897370E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1826   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3498612938E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1827   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3430775115E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1828   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7346276735E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1829   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2698876228E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1830   -0.1000000000+201    0.7192048474E-04   -0.1000000000+201    0.6326868001E-02    0.1358072675E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1831   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1350818458E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1832   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7108163476E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1833   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2751520853E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1834   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4611399617E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1835   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4545177382E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1836   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6516243017E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1837   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2546674732E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1838   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4308779409E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1839   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4301870972E-12        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1840   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1764571603E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1841   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1110174131E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1842   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1273336866E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1843   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5938169102E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1844   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5849804972E-14        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1845   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5188215072E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1846   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5988641564E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1847   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1844011765E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1848   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1775614400E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1849   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8279334811E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1850   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3071542257E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1851   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3060312777E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1852   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2994739563E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1853   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8118575511E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1854   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3230387911E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619328E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1855   -0.1000000000+201    0.7192048474E-04   -0.1000000000+201    0.6326868001E-02    0.1026234872E-11        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1856   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1025570228E-11        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1857   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6967680110E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1858   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2922348853E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1859   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6069301498E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1860   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6011300053E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1861   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6553415291E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1862   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3709247183E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1863   -0.1000000000+201    0.7192048474E-04   -0.1000000000+201    0.6326868001E-02    0.3439191115E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1864   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3433551350E-12        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1865   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5935033850E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1866   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1237698957E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1867   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1171750263E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1868   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7172832408E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1869   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1984823423E-14        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1870   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1455678848E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1871   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8019164372E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1872   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3147765326E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619328E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1873   -0.1000000000+201    0.7192048474E-04   -0.1000000000+201    0.6326868001E-02    0.1315871136E-11        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1874   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1315219105E-11        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1875   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9437050301E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1876   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4263733187E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1877   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2205645021E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1878   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2133509159E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1879   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6847117699E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1880   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2341290654E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1881   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1765968559E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1882   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8736997111E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1883   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3339366905E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1884   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1451727592E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1885   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1382444012E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1886   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8800610940E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1887   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3857983157E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1888   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3015024794E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1889   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2949320099E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1890   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7477255045E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1891   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2531835027E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1892   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7092405998E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1893   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7026951237E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1894   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8563420631E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1895   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3306472295E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1896   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1319226262E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1897   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1246703572E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1898   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7090918844E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1899   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4126190445E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 checkrep> number of active repulsions and total=      69      69
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1900   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8325992715E-15        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1901   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4160612986E-15        15     3
 Search direction has positive projection onto gradient - reversing step
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1902   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1546955998E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1903   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1540100347E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1904   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7618155324E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1905   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9071737189E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1906   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6028987956E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1907   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6388676097E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1908   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5696345742E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1909   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8878105037E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1910   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3535901782E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1911   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3725875426E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1912   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3661832826E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1913   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6967669940E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1914   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2011322137E-14        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1915   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1543710070E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1916   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9411829039E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1917   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3332548319E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1918   -0.1000000000+201    0.7192048474E-04   -0.1000000000+201    0.6326868001E-02    0.1179104710E-11        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1919   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1178460439E-11        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1920   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7723183959E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1921   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2973500991E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1922   -0.1000000000+201    0.7192048474E-04   -0.1000000000+201    0.6326868001E-02    0.2372001181E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1923   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2364840036E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1924   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7850326443E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1925   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3312041471E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1926   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1523490114E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1927   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1516752555E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1928   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8063589417E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1929   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3423028865E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1930   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3203689081E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1931   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3140280572E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1932   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8194721231E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1933   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3340639916E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1934   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2743529505E-12        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1935   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2736921407E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1936   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8265429284E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1937   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6528990138E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1938   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3825884787E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1939   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1652367120E-12        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1940   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1645484530E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1941   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5961131978E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1942   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1948869626E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1943   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1882453854E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1944   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7809174725E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1945   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3387256778E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1946   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4752856280E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1947   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4683184316E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1948   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7638408556E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1949   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3135481076E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1950   -0.1000000000+201    0.7192048474E-04   -0.1000000000+201    0.6326868001E-02    0.1478179496E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1951   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1471070904E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1952   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7881005586E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1953   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3340812594E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1954   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4525320461E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1955   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4457177999E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1956   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8219124300E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1957   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3012642193E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1958   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3594209313E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1959   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3528100530E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1960   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7195819493E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1961   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2743112717E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1962   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2339045210E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1963   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2332445347E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1964   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7686064060E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1965   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3121838326E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1966   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7501901351E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1967   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7435295230E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1968   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6837770619E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1969   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3127900056E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1970   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3090372738E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1971   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3032786712E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1972   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6801696765E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1973   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2803624379E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1974   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2118820630E-14        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1975   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5500042455E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1976   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2016978248E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1977   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1208351393E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1978   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.4788573471E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1979   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5687739480E-12        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1980   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.5680974243E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1981   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9022204224E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1982   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3512187332E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1983   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3599585599E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1984   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3533822704E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1985   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6581158013E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1986   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2487122327E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1987   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8381759544E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1988   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8317710575E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1989   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7480279995E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1990   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3095043675E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619328E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1991   -0.1000000000+201    0.7192048474E-04   -0.1000000000+201    0.6326868001E-02    0.7187739821E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1992   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7181139601E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1993   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8449309969E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1994   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3175187849E-15        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1995   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3324806387E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1996   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3254626936E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1997   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7498055742E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1998   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3091129535E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   1999   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3458621946E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 checkrep> number of active repulsions and total=      69      69
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2000   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3391940575E-13        15     3
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2001   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.6640020497E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2002   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2996451410E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2003   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7945994461E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2004   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7365154880E-14        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2005   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7100789100E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2006   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1387933495E-14        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2007   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8056061947E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2008   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.3080248185E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2009   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1478472322E-12        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2010   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.1471557939E-12        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2011   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7327756690E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2012   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.2838292561E-15        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2013   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.9018645959E-13        15     3
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2014   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.8950778170E-13        15     3
 intlbfgs> Mean deviation     0.1755619327E-01 Decreasing QCI force constant to      1.000000000    
 intlbfgs> largest atomic distance between images is     0.3874434098     for atom     10 and images      1     2 total images=     1
 congrad> Highest repulsion  for image      2 ind     24 atoms      7    10 value=    0.71920E-04 d,cutoff=     3.3344         3.3508     max grad=    0.63269E-02
 congrad> Highest spring  contribution for any image in image      1
 congrad> mean gap and mean deviation=    0.7133346964        0.1755619327E-01
 intlbfgs> Highest QCI image energy=    0.7749335393E-04 images=       1
 intlbfgs> Highest image        2 energy     0.7749335393E-04 is      0.000000000     sigma from the mean
 intlbfgs> steps:   2015   -0.1000000000+201    0.7192048475E-04   -0.1000000000+201    0.6326868001E-02    0.7468252698E-15        15     3
 intlbfgs> energies for images:
     1        0.0000000000
     2        0.0000774934
     3        0.0000000000
 intlbfgs> After   2015 steps, energy/image=    0.7749335393E-04 RMS= 0.23266692E-15 images=   1
 intlbfgs> WORST=    0.7749335393E-04
 intlbfgs> retaining        1 QCI images, highest energy=    0.7749335393E-04
 intrwg> USEFRACT=    F
 intrwg> Interpolated image coordinates were saved to xyz file "int.xyz"
 writeprofile> Interpolated energy profile was saved to file "int.EofS"
 tryconnect> Number of proposed DNEB images        3 exceeds number from QCI. Redistributing.
 imageredistribution2> total distance=     1.426669393     regular spacing     0.3566673482    
 imageredistribution2> placing image      2 at image      1 energy     -273.6091606    
 imageredistribution2> placing image      3 at image      1 energy     -273.6091606    
 imageredistribution2> placing image      4 at image      2 energy     -273.6064691    
 imageredistribution2> new distances:
       1     0.000000000    
       2     0.000000000    
       3     0.000000000    
       4    0.7134599308    
       5     1.426669393    
 tryconnect> 45-iteration DNEB run for      3 images with RMS convergence condition     0.1000000000E-03 newneb> Number of atoms or variables =           15
 KeyNEB> Initial and final NEB force constants     10.00000000        10.00000000     factor=    1.000000000    
 KeyNEB> Using 3 images
 KeyNEB> NEB coordinates will be saved to xyz file "neb.xyz" every 100 iterations
 KeyNEB> Energy profile will be saved to file "neb.EofS" every 100 iterations
 KeyNEB> Verbose printing is on
 KeyNEB> Evolution of AvDev, E, Rms and S will be saved to files "AvDevofI", "EofI", "RmsofI" and "SofI"
 rwg> NEB coordinates were saved to xyz file "neb.0.xyz"
                  Iter   Energy per image      RMS Force       Av.Dev    Path     Step length/images      k(1)
tangent vector problem for image        1 WMINUS and WPLUS=    0.2380393604E-02    0.2691425740E-02 EM=    -273.6091644    
 writeprofile> NEB profile was saved to file "neb.EofS.0"
 nebbfgs> steps:      1    -273.6082598        0.4955073016       89.67%  1.43             0.24560E-01        10.000    
 nebbfgs> steps:      2    -273.6080910        0.3093736811       61.64%  1.43             0.72273E-01        10.000    
 nebbfgs> steps:      3    -273.6079447        0.1896883196       33.61%  1.43             0.84089E-01        10.000    
 nebbfgs> steps:      4    -273.6081831        0.2988305395E-01    5.64%  1.43             0.10202            10.000    
 nebbfgs> steps:      5    -273.6084131        0.3052867550E-01    0.38%  1.43             0.19742E-01        10.000    
 nebbfgs> steps:      6    -273.6084067        0.3307363682E-01    1.59%  1.43             0.83525E-02        10.000    
 nebbfgs> steps:      7    -273.6083886        0.6711533959E-02    0.08%  1.43             0.58115E-02        10.000    
 nebbfgs> steps:      8    -273.6084244        0.5226946347E-02    0.05%  1.43             0.11233E-02        10.000    
 nebbfgs> steps:      9    -273.6084628        0.5245166756E-02    0.09%  1.43             0.85720E-03        10.000    
 nebbfgs> steps:     10    -273.6086597        0.3254813880E-01    0.32%  1.43             0.76977E-02        10.000    
 nebbfgs> steps:     11    -273.6085089        0.4110309866E-02    0.04%  1.43             0.66296E-02        10.000    
 nebbfgs> steps:     12    -273.6085411        0.3673265343E-02    0.03%  1.43             0.90591E-03        10.000    
 nebbfgs> steps:     13    -273.6087189        0.4792473043E-01    0.16%  1.43             0.12521E-01        10.000    
 nebbfgs> steps:     14    -273.6085714        0.3413641686E-02    0.01%  1.43             0.11579E-01        10.000    
 nebbfgs> steps:     15    -273.6085949        0.3566920817E-02    0.01%  1.43             0.89668E-03        10.000    
 nebbfgs> steps:     16    -273.6087090        0.1123539185E-01    0.04%  1.43             0.55638E-02        10.000    
 nebbfgs> steps:     17    -273.6087744        0.4663435635E-01    0.11%  1.43             0.77439E-02        10.000    
 nebbfgs> steps:     18    -273.6087139        0.8766381122E-02    0.05%  1.43             0.72416E-02        10.000    
 nebbfgs> steps:     19    -273.6087111        0.1853002313E-01    0.04%  1.43             0.11502E-02        10.000    
 nebbfgs> Decreasing DNEB force constant to      9.708737864    
 nebbfgs> steps:     20    -273.6087072        0.7202709974E-02    0.04%  1.43             0.57649E-03        9.7087    
 nebbfgs> steps:     21    -273.6087120        0.7668922785E-02    0.04%  1.43             0.58605E-03        9.7087    
 nebbfgs> steps:     22    -273.6087101        0.2081358827E-02    0.04%  1.43             0.35254E-03        9.7087    
 nebbfgs> steps:     23    -273.6087124        0.1949545632E-02    0.04%  1.43             0.16045E-03        9.7087    
 nebbfgs> steps:     24    -273.6086730        0.8146090986E-01    0.28%  1.44             0.22771E-01        9.7087    
 nebbfgs> steps:     25    -273.6087211        0.2613026820E-02    0.02%  1.43             0.22109E-01        9.7087    
 nebbfgs> steps:     26    -273.6087273        0.8078362250E-02    0.01%  1.43             0.70315E-03        9.7087    
 nebbfgs> steps:     27    -273.6087287        0.2859553763E-02    0.01%  1.43             0.26946E-03        9.7087    
 nebbfgs> steps:     28    -273.6087355        0.5002058100E-02    0.01%  1.43             0.55473E-03        9.7087    
 nebbfgs> steps:     29    -273.6087516        0.9478061492E-02    0.01%  1.43             0.14995E-02        9.7087    
 nebbfgs> steps:     30    -273.6087689        0.8923823976E-02    0.03%  1.43             0.19773E-02        9.7087    
 nebbfgs> steps:     31    -273.6088046        0.3298250475E-01    0.06%  1.43             0.60001E-02        9.7087    
 nebbfgs> steps:     32    -273.6087743        0.5254708079E-02    0.03%  1.43             0.50120E-02        9.7087    
 nebbfgs> steps:     33    -273.6087648        0.6497525418E-02    0.02%  1.43             0.15263E-02        9.7087    
 nebbfgs> steps:     34    -273.6087707        0.2811237690E-02    0.02%  1.43             0.83857E-03        9.7087    
 nebbfgs> steps:     35    -273.6087750        0.2243100735E-02    0.03%  1.43             0.63009E-03        9.7087    
 nebbfgs> steps:     36    -273.6087760        0.1195068747E-02    0.02%  1.43             0.11863E-03        9.7087    
 nebbfgs> steps:     37    -273.6087848        0.1355697303E-01    0.02%  1.43             0.11757E-02        9.7087    
 nebbfgs> steps:     38    -273.6087798        0.3364934400E-02    0.02%  1.43             0.69161E-03        9.7087    
 nebbfgs> steps:     39    -273.6087826        0.3876857589E-02    0.02%  1.43             0.40801E-03        9.7087    
 Search direction has positive projection onto gradient - reversing step
 nebbfgs> Decreasing DNEB force constant to      9.425959091    
 nebbfgs> steps:     40    -273.6088121        0.3947602197E-01    0.02%  1.44             0.58949E-02        9.4260    
 nebbfgs> steps:     41    -273.6087859        0.3365045985E-02    0.02%  1.43             0.53921E-02        9.4260    
 nebbfgs> steps:     42    -273.6087868        0.8257404198E-02    0.02%  1.43             0.30395E-03        9.4260    
 nebbfgs> steps:     43    -273.6087866        0.9383426281E-03    0.02%  1.43             0.18118E-03        9.4260    
 nebbfgs> steps:     44    -273.6087875        0.1396426616E-02    0.02%  1.43             0.13890E-03        9.4260    
 nebbfgs> steps:     45    -273.6088055        0.2678739513E-01    0.01%  1.43             0.33750E-02        9.4260    
 nebbfgs> Final DNEB force constant      9.425959091    
 newneb> mean image separation is       0.3586
 writeprofile> NEB profile was saved to file "neb.EofS"
 rwg> NEB coordinates were saved to xyz file "neb.xyz"
 Time to go through NEB:   0.31582800000000066     
 Reached maximal number of iterations limit.
 time= 0.32 sec (0.01 sec/iteration)
 No maximum in profile - using highest image
 Following    1 images are candidates for TS:    2  
 Index of first candidate is            3
 bfgsts> resetting maximum uphill step size to     0.2000000000E-01

 BFGSTS> Beginning of optimization cycle    1.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.22591E-02   -0.17409E-02   -0.27772E-02  -273.608718806      -273.608719640      -273.608719222     0.148E-01
predicted gradient component=    0.4170754835E-03
xmylbfgs> Eigenvalue and RMS=   -0.1740947103E-02    0.1482709733E-01 after      0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.24240E-02   -0.18350E-02   -0.30131E-02  -273.608718807      -273.608719639      -273.608719222     0.142E-01
predicted gradient component=    0.4158189881E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.1834966201E-02   0.1422112975E-01    5.123750896     after      1 steps, step: 0.0009892927
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.35919E-02   -0.30513E-02   -0.41326E-02  -273.608718846      -273.608719602      -273.608719222     0.287E-02
predicted gradient component=    0.3777940094E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3051308630E-02   0.2874591131E-02    39.86297608     after      2 steps, step: 0.0256726442
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.36290E-02   -0.31189E-02   -0.41391E-02  -273.608718857      -273.608719591      -273.608719222     0.243E-02
predicted gradient component=    0.3670974991E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3118918707E-02   0.2428583916E-02    2.167740915     after      3 steps, step: 0.0051761360
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.37060E-02   -0.32088E-02   -0.42031E-02  -273.608718877      -273.608719571      -273.608719222     0.226E-02
predicted gradient component=    0.3468470027E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3208778278E-02   0.2261062911E-02    2.800429441     after      4 steps, step: 0.0097288979
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.38480E-02   -0.33212E-02   -0.43747E-02  -273.608718908      -273.608719540      -273.608719222     0.200E-02
predicted gradient component=    0.3155130059E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3321240533E-02   0.1995108375E-02    3.386152050     after      5 steps, step: 0.0172699608
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.38341E-02   -0.33819E-02   -0.42862E-02  -273.608718953      -273.608719495      -273.608719222     0.411E-02
predicted gradient component=    0.2707909914E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3381943474E-02   0.4113567328E-02    1.794912944     after      6 steps, step: 0.0284751379
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.39830E-02   -0.34747E-02   -0.44913E-02  -273.608718958      -273.608719490      -273.608719222     0.179E-02
predicted gradient component=    0.2656735205E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3474699273E-02   0.1788480781E-02    2.669462656     after      7 steps, step: 0.0084861879
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.40370E-02   -0.35278E-02   -0.45462E-02  -273.608718962      -273.608719486      -273.608719222     0.151E-02
predicted gradient component=    0.2622235229E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3527807247E-02   0.1509214666E-02    1.505410300     after      8 steps, step: 0.0105043318
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.41319E-02   -0.35801E-02   -0.46838E-02  -273.608718968      -273.608719481      -273.608719222     0.182E-02
predicted gradient component=    0.2564840145E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3580075593E-02   0.1818728857E-02    1.459978822     after      9 steps, step: 0.0154788723
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.41271E-02   -0.36253E-02   -0.46289E-02  -273.608718977      -273.608719471      -273.608719222     0.402E-02
predicted gradient component=    0.2471495009E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3625259595E-02   0.4022920473E-02    1.246365991     after     10 steps, step: 0.0361517833
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.42020E-02   -0.37035E-02   -0.47005E-02  -273.608718978      -273.608719471      -273.608719222     0.167E-02
predicted gradient component=    0.2465380078E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3703470037E-02   0.1670613009E-02    2.111815162     after     11 steps, step: 0.0093376636
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.43100E-02   -0.37535E-02   -0.48665E-02  -273.608718976      -273.608719473      -273.608719222     0.147E-02
predicted gradient component=    0.2486939934E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3753503049E-02   0.1471595493E-02    1.332968459     after     12 steps, step: 0.0118422452
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.43100E-02   -0.37982E-02   -0.48217E-02  -273.608718971      -273.608719477      -273.608719222     0.158E-02
predicted gradient component=    0.2527550009E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3798214303E-02   0.1576342398E-02    1.177165119     after     13 steps, step: 0.0158491391
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.44121E-02   -0.38963E-02   -0.49279E-02  -273.608718963      -273.608719486      -273.608719222     0.207E-02
predicted gradient component=    0.2615859955E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3896263542E-02   0.2068807484E-02    2.516494035     after     14 steps, step: 0.0363495550
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.43210E-02   -0.38008E-02   -0.48412E-02  -273.608718937      -273.608719511      -273.608719222     0.840E-02
predicted gradient component=    0.2869294917E-03
 eigenvalue increased from       -0.0038962635 to -0.3800797904E-02 decreasing step to      0.00998989
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.44471E-02   -0.39252E-02   -0.49690E-02  -273.608718960      -273.608719489      -273.608719222     0.175E-02
predicted gradient component=    0.2642645143E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3925175327E-02   0.1753257749E-02   0.7365730788     after     15 steps, step: 0.0099898893
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.45480E-02   -0.40495E-02   -0.50466E-02  -273.608718942      -273.608719506      -273.608719222     0.144E-02
predicted gradient component=    0.2821369947E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.4049507259E-02   0.1443513179E-02    3.070297793     after     16 steps, step: 0.0655073336
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.45751E-02   -0.41472E-02   -0.50030E-02  -273.608718931      -273.608719518      -273.608719222     0.122E-02
predicted gradient component=    0.2938064938E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.4147236776E-02   0.1222998315E-02    2.356497153     after     17 steps, step: 0.0448901442
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.47650E-02   -0.42401E-02   -0.52898E-02  -273.608718921      -273.608719528      -273.608719222     0.265E-02
predicted gradient component=    0.3034864733E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.4240088331E-02   0.2652400043E-02    2.189849544     after     18 steps, step: 0.0669972542
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.47530E-02   -0.42886E-02   -0.52175E-02  -273.608718912      -273.608719537      -273.608719222     0.277E-02
predicted gradient component=    0.3128404842E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.4288574368E-02   0.2769578878E-02    1.130586380     after     19 steps, step: 0.0376597103
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.48670E-02   -0.43399E-02   -0.53942E-02  -273.608718913      -273.608719536      -273.608719222     0.130E-02
predicted gradient component=    0.3117384892E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.4339926520E-02   0.1299565832E-02    1.183249342     after     20 steps, step: 0.0140581698
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.49110E-02   -0.43843E-02   -0.54378E-02  -273.608718912      -273.608719537      -273.608719222     0.116E-02
predicted gradient component=    0.3126525030E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.4384261516E-02   0.1162275131E-02    1.011230636     after     21 steps, step: 0.0114991764
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.50190E-02   -0.44283E-02   -0.56098E-02  -273.608718907      -273.608719542      -273.608719222     0.199E-02
predicted gradient component=    0.3177185022E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.4428336198E-02   0.1993982215E-02   0.9952876119     after     22 steps, step: 0.0303691321
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.49821E-02   -0.44666E-02   -0.54976E-02  -273.608718901      -273.608719549      -273.608719222     0.201E-02
predicted gradient component=    0.3239279920E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.4466552972E-02   0.2006673607E-02   0.8556212168     after     23 steps, step: 0.0505416181
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.49480E-02   -0.44986E-02   -0.53974E-02  -273.608718898      -273.608719551      -273.608719222     0.119E-02
predicted gradient component=    0.3268119997E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.4498632706E-02   0.1189123967E-02   0.7130996483     after     24 steps, step: 0.0190401612
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.50491E-02   -0.45469E-02   -0.55512E-02  -273.608718893      -273.608719556      -273.608719222     0.150E-02
predicted gradient component=    0.3311974979E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.4546937416E-02   0.1499050886E-02    1.062357029     after     25 steps, step: 0.0332753902
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.51231E-02   -0.45963E-02   -0.56499E-02  -273.608718890      -273.608719559      -273.608719222     0.189E-02
predicted gradient component=    0.3341994841E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.4596256376E-02   0.1886142376E-02    1.073024564     after     26 steps, step: 0.0321991839
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.51620E-02   -0.46715E-02   -0.56524E-02  -273.608718886      -273.608719563      -273.608719222     0.155E-02
predicted gradient component=    0.3385469824E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.4671507406E-02   0.1554288644E-02    1.610851135     after     27 steps, step: 0.0552227007
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.51970E-02   -0.46124E-02   -0.57816E-02  -273.608718885      -273.608719564      -273.608719222     0.388E-02
predicted gradient component=    0.3396154966E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.4612377759E-02   0.3884772604E-02    1.281977543     after     28 steps, step: 0.0289290021
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.51881E-02   -0.46952E-02   -0.56810E-02  -273.608718886      -273.608719564      -273.608719222     0.471E-03
predicted gradient component=    0.3391039911E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.4695189153E-02   0.4709181599E-03    1.763749913     after     29 steps, step: 0.0115766368
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.51740E-02   -0.46982E-02   -0.56498E-02  -273.608718886      -273.608719564      -273.608719222     0.341E-03
predicted gradient component=    0.3390069878E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.4698178325E-02   0.3408169046E-03   0.6362404846E-01 after     30 steps, step: 0.0059695454
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.52811E-02   -0.47040E-02   -0.58582E-02  -273.608718885      -273.608719564      -273.608719222     0.502E-03
predicted gradient component=    0.3394794987E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.4704002414E-02   0.5022870389E-03   0.1238113720     after     31 steps, step: 0.0097425912
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.51450E-02   -0.47087E-02   -0.55813E-02  -273.608718884      -273.608719566      -273.608719222     0.563E-03
predicted gradient component=    0.3411315106E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.4708749219E-02   0.5633864107E-03   0.1008081867     after     32 steps, step: 0.0049752851
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.52680E-02   -0.47086E-02   -0.58274E-02  -273.608718881      -273.608719568      -273.608719222     0.103E-02
predicted gradient component=    0.3435069971E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.4708620666E-02   0.1032031478E-02   0.2730159335E-02 after     33 steps, step: 0.0124654357
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.52690E-02   -0.47153E-02   -0.58228E-02  -273.608718880      -273.608719569      -273.608719222     0.219E-03
predicted gradient component=    0.3446955077E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.4715255834E-02   0.2193767824E-03   0.1407170191     after     34 steps, step: 0.0094751088
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.51940E-02   -0.47160E-02   -0.56720E-02  -273.608718880      -273.608719570      -273.608719222     0.153E-03
predicted gradient component=    0.3448379857E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.4716032306E-02   0.1531324670E-03   0.1646453066E-01 after     35 steps, step: 0.0033390470
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.51920E-02   -0.47173E-02   -0.56667E-02  -273.608718880      -273.608719570      -273.608719222     0.261E-03
predicted gradient component=    0.3450769839E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.4717265830E-02   0.2609344644E-03   0.2614913136E-01 after     36 steps, step: 0.0053480005
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.52140E-02   -0.47189E-02   -0.57091E-02  -273.608718879      -273.608719570      -273.608719222     0.406E-03
predicted gradient component=    0.3453479849E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.4718901188E-02   0.4064731004E-03   0.3465547047E-01 after     37 steps, step: 0.0055947990
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.52120E-02   -0.47222E-02   -0.57017E-02  -273.608718879      -273.608719570      -273.608719222     0.536E-03
predicted gradient component=    0.3455670026E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.4722205772E-02   0.5355784365E-03   0.6997968216E-01 after     38 steps, step: 0.0094189805
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.52290E-02   -0.47236E-02   -0.57345E-02  -273.608718880      -273.608719570      -273.608719222     0.849E-03
predicted gradient component=    0.3449414976E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.4723585356E-02   0.8494474766E-03   0.2920628488E-01 after     39 steps, step: 0.0134757929
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.51990E-02   -0.47272E-02   -0.56708E-02  -273.608718879      -273.608719570      -273.608719222     0.301E-03
predicted gradient component=    0.3453245085E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.4727226935E-02   0.3006927658E-03   0.7703414427E-01 after     40 steps, step: 0.0028765044
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.53050E-02   -0.47282E-02   -0.58817E-02  -273.608718880      -273.608719570      -273.608719222     0.137E-03
predicted gradient component=    0.3451355042E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.4728195102E-02   0.1368957936E-03   0.2047646604E-01 after     41 steps, step: 0.0047779443
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.52020E-02   -0.47287E-02   -0.56753E-02  -273.608718880      -273.608719570      -273.608719222     0.171E-03
predicted gradient component=    0.3450909958E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.4728676521E-02   0.1705891191E-03   0.1018083238E-01 after     42 steps, step: 0.0032776081
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.53060E-02   -0.47294E-02   -0.58826E-02  -273.608718879      -273.608719570      -273.608719222     0.234E-03
predicted gradient component=    0.3452390160E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.4729351770E-02   0.2339165212E-03   0.1427783237E-01 after     43 steps, step: 0.0028452843
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.51970E-02   -0.47307E-02   -0.56633E-02  -273.608718879      -273.608719571      -273.608719222     0.260E-03
predicted gradient component=    0.3458455069E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.4730674567E-02   0.2599575617E-03   0.2796212420E-01 after     44 steps, step: 0.0045537450
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.52030E-02   -0.47324E-02   -0.56736E-02  -273.608718878      -273.608719571      -273.608719222     0.173E-03
predicted gradient component=    0.3465015084E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.4732412446E-02   0.1729725223E-03   0.3672289896E-01 after     45 steps, step: 0.0068286725
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.53141E-02   -0.47339E-02   -0.58942E-02  -273.608718878      -273.608719571      -273.608719222     0.152E-03
predicted gradient component=    0.3467430076E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.4733891621E-02   0.1521113117E-03   0.3124648727E-01 after     46 steps, step: 0.0090891638
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.52199E-02   -0.47342E-02   -0.57056E-02  -273.608718878      -273.608719571      -273.608719222     0.258E-03
predicted gradient component=    0.3463399878E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.4734231234E-02   0.2583804787E-03   0.7173575142E-02 after     47 steps, step: 0.0065540055
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.52170E-02   -0.47347E-02   -0.56992E-02  -273.608718879      -273.608719571      -273.608719222     0.128E-03
predicted gradient component=    0.3460864946E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.4734715618E-02   0.1277525907E-03   0.1023046892E-01 after     48 steps, step: 0.0016981859
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.51830E-02   -0.47350E-02   -0.56310E-02  -273.608718879      -273.608719570      -273.608719222     0.817E-04
predicted gradient component=    0.3455305091E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.4735007515E-02   0.8165692045E-04   0.6164653282E-02 after     49 steps, step: 0.0015771096
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.51981E-02   -0.47352E-02   -0.56610E-02  -273.608718880      -273.608719570      -273.608719222     0.491E-04
predicted gradient component=    0.3449380017E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.4735188724E-02   0.4906235867E-04   0.3826852982E-02 after     50 steps, step: 0.0017361024
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.52880E-02   -0.47352E-02   -0.58408E-02  -273.608718880      -273.608719569      -273.608719222     0.425E-04
predicted gradient component=    0.3444440040E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.4735249077E-02   0.4246531601E-04   0.1274555119E-02 after     51 steps, step: 0.0014263670
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.52790E-02   -0.47353E-02   -0.58228E-02  -273.608718881      -273.608719569      -273.608719222     0.588E-04
predicted gradient component=    0.3439934915E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.4735343824E-02   0.5875934587E-04   0.2000850093E-02 after     52 steps, step: 0.0014283418
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.51790E-02   -0.47354E-02   -0.56226E-02  -273.608718881      -273.608719568      -273.608719222     0.650E-04
predicted gradient component=    0.3434724931E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.4735415487E-02   0.6497215441E-04   0.1513350320E-02 after     53 steps, step: 0.0011286162
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.51990E-02   -0.47354E-02   -0.56626E-02  -273.608718882      -273.608719568      -273.608719222     0.680E-04
predicted gradient component=    0.3431684945E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.4735423148E-02   0.6800161414E-04   0.1617808401E-03 after     54 steps, step: 0.0008831963
 xmylbfgs> Smallest eigenvalue converged in   54 steps. Eigenvalue=     -0.0047354 RMS force=      0.0000680 % change=    0.16178E-03
 xmylbfgs> Diagonal inverse Hessian elements are now         0.7146879258
beig> Overlap with previous vector=      0.8577820
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1    0.343268E-03   -0.473542E-02  0.200000E-01  0.220000E-01    0.131158E-01
 -------------------------------------------------------------------------------
 mylbfgs> Resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6087133        0.4204985591E-03 after      0 steps
 mylbfgs> true and projected RMS:     0.4221441992E-03    0.4204985591E-03
 mylbfgs> Energy and RMS force=    -273.6087133        0.4204366604E-03 after      1 steps, step:  0.79569E-06
 mylbfgs> true and projected RMS:     0.4220824111E-03    0.4204366604E-03
 mylbfgs> Energy and RMS force=    -273.6087280        0.4105209012E-03 after      2 steps, step:  0.97091E-02
 mylbfgs> true and projected RMS:     0.4125989111E-03    0.4105209012E-03
 mylbfgs> Energy and RMS force=    -273.6087293        0.8567583272E-03 after      3 steps, step:  0.74563E-02
 mylbfgs> true and projected RMS:     0.8577466615E-03    0.8567583272E-03
 mylbfgs> Energy and RMS force=    -273.6087344        0.2579594682E-03 after      4 steps, step:  0.15756E-02
 mylbfgs> true and projected RMS:     0.2613024348E-03    0.2579594682E-03
 bfgsts> RMS grad=    0.2613024348E-03 subspace grad=    0.2579594682E-03 unscaled EF step length=    0.7211244680E-01

 BFGSTS> Beginning of optimization cycle    2.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.30010E-02   -0.32604E-02   -0.27416E-02  -273.608734128      -273.608734687      -273.608734406     0.320E-02
predicted gradient component=    0.2794814975E-03
xmylbfgs> Eigenvalue and RMS=   -0.3260399870E-02    0.3195894951E-02 after      0 steps
 xmylbfgs> Turning off convergence after 0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.29351E-02   -0.32590E-02   -0.26111E-02  -273.608734128      -273.608734687      -273.608734406     0.317E-02
predicted gradient component=    0.2794524789E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3258992688E-02   0.3171434979E-02   0.4317842228E-01 after      1 steps, step: 0.0000459619
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.29440E-02   -0.33261E-02   -0.25620E-02  -273.608734128      -273.608734687      -273.608734406     0.103E-02
predicted gradient component=    0.2795570140E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3326108614E-02   0.1025347491E-02    2.017851309     after      2 steps, step: 0.0069214491
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.30881E-02   -0.33314E-02   -0.28448E-02  -273.608734129      -273.608734687      -273.608734406     0.851E-03
predicted gradient component=    0.2789219877E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3331365890E-02   0.8508978414E-03   0.1578114217     after      3 steps, step: 0.0017227741
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.29661E-02   -0.33349E-02   -0.25973E-02  -273.608734129      -273.608734686      -273.608734406     0.671E-03
predicted gradient component=    0.2787450057E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3334919879E-02   0.6707669961E-03   0.1065689365     after      4 steps, step: 0.0008829545
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.30331E-02   -0.33484E-02   -0.27177E-02  -273.608734130      -273.608734685      -273.608734406     0.455E-03
predicted gradient component=    0.2777784971E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3348410431E-02   0.4551249907E-03   0.4028942206     after      5 steps, step: 0.0070494066
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.30660E-02   -0.33512E-02   -0.27808E-02  -273.608734129      -273.608734687      -273.608734406     0.710E-03
predicted gradient component=    0.2789809912E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3351228285E-02   0.7095269909E-03   0.8408421767E-01 after      6 steps, step: 0.0032721651
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.29191E-02   -0.33544E-02   -0.24839E-02  -273.608734128      -273.608734687      -273.608734406     0.413E-03
predicted gradient component=    0.2798514913E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3354386701E-02   0.4126516913E-03   0.9415777955E-01 after      7 steps, step: 0.0020005442
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.30470E-02   -0.33580E-02   -0.27361E-02  -273.608734125      -273.608734690      -273.608734406     0.360E-03
predicted gradient component=    0.2823425120E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3357957686E-02   0.3596142808E-03   0.1063439447     after      8 steps, step: 0.0037254232
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.30191E-02   -0.33601E-02   -0.26780E-02  -273.608734124      -273.608734692      -273.608734406     0.474E-03
predicted gradient component=    0.2841094897E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3360117554E-02   0.4741236205E-03   0.6427953075E-01 after      9 steps, step: 0.0029960399
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.30890E-02   -0.33628E-02   -0.28152E-02  -273.608734121      -273.608734694      -273.608734406     0.359E-03
predicted gradient component=    0.2867074897E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3362782632E-02   0.3588669371E-03   0.7925217351E-01 after     10 steps, step: 0.0043519720
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.30041E-02   -0.33648E-02   -0.26434E-02  -273.608734120      -273.608734695      -273.608734406     0.222E-03
predicted gradient component=    0.2873990184E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3364758305E-02   0.2222009106E-03   0.5871663538E-01 after     11 steps, step: 0.0026684263
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.30510E-02   -0.33661E-02   -0.27360E-02  -273.608734120      -273.608734695      -273.608734406     0.217E-03
predicted gradient component=    0.2872654932E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3366068775E-02   0.2165769791E-03   0.3893177055E-01 after     12 steps, step: 0.0021798369
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.30471E-02   -0.33671E-02   -0.27272E-02  -273.608734121      -273.608734695      -273.608734406     0.367E-03
predicted gradient component=    0.2870415017E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3367111945E-02   0.3667044014E-03   0.3098115706E-01 after     13 steps, step: 0.0027168051
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.30560E-02   -0.33683E-02   -0.27437E-02  -273.608734121      -273.608734694      -273.608734406     0.264E-03
predicted gradient component=    0.2866819955E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3368310820E-02   0.2638811919E-03   0.3559274696E-01 after     14 steps, step: 0.0022527506
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.30391E-02   -0.33696E-02   -0.27085E-02  -273.608734121      -273.608734694      -273.608734406     0.178E-03
predicted gradient component=    0.2866154887E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3369623349E-02   0.1777200373E-03   0.3895181139E-01 after     15 steps, step: 0.0028680015
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.30030E-02   -0.33703E-02   -0.26358E-02  -273.608734121      -273.608734694      -273.608734406     0.193E-03
predicted gradient component=    0.2866345028E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3370299609E-02   0.1927625683E-03   0.2006528254E-01 after     16 steps, step: 0.0024194622
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.29970E-02   -0.33705E-02   -0.26235E-02  -273.608734121      -273.608734694      -273.608734406     0.193E-03
predicted gradient component=    0.2866605087E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3370480707E-02   0.1929688932E-03   0.5373047749E-02 after     17 steps, step: 0.0014993598
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.30241E-02   -0.33707E-02   -0.26774E-02  -273.608734121      -273.608734694      -273.608734406     0.787E-04
predicted gradient component=    0.2867059834E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3370711840E-02   0.7867830766E-04   0.6857116296E-02 after     18 steps, step: 0.0003993114
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.30030E-02   -0.33707E-02   -0.26353E-02  -273.608734121      -273.608734694      -273.608734406     0.647E-04
predicted gradient component=    0.2865224928E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3370728222E-02   0.6469072599E-04   0.4859871125E-03 after     19 steps, step: 0.0002993185
 xmylbfgs> Smallest eigenvalue converged in   19 steps. Eigenvalue=     -0.0033707 RMS force=      0.0000647 % change=    0.48599E-03
 xmylbfgs> Diagonal inverse Hessian elements are now         0.1966949853
beig> Overlap with previous vector=      0.9993998
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1    0.286655E-03   -0.337073E-02  0.220000E-01  0.242000E-01    0.273759E-01
 -------------------------------------------------------------------------------
 mylbfgs> Not resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6087289        0.2574344796E-03 after      0 steps
 mylbfgs> true and projected RMS:     0.2594132590E-03    0.2574344796E-03
 mylbfgs> Energy and RMS force=    -273.6087301        0.1799311011E-03 after      1 steps, step:  0.10805E-02
 mylbfgs> true and projected RMS:     0.1827451830E-03    0.1799311011E-03
 mylbfgs> Energy and RMS force=    -273.6087317        0.2160297057E-03 after      2 steps, step:  0.25995E-02
 mylbfgs> true and projected RMS:     0.2183790934E-03    0.2160297057E-03
 mylbfgs> Energy and RMS force=    -273.6087331        0.1804697630E-03 after      3 steps, step:  0.29064E-02
 mylbfgs> true and projected RMS:     0.1833263941E-03    0.1804697630E-03
 mylbfgs> Energy and RMS force=    -273.6087329        0.4648777358E-03 after      4 steps, step:  0.48323E-02
 mylbfgs> true and projected RMS:     0.4659697204E-03    0.4648777358E-03
 bfgsts> RMS grad=    0.4659697204E-03 subspace grad=    0.4648777358E-03 unscaled EF step length=    0.8443616176E-01

 BFGSTS> Beginning of optimization cycle    3.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.27450E-02   -0.31346E-02   -0.23554E-02  -273.608732652      -273.608733079      -273.608732864     0.370E-02
predicted gradient component=    0.2138315267E-03
xmylbfgs> Eigenvalue and RMS=   -0.3134581095E-02    0.3698682551E-02 after      0 steps
 xmylbfgs> Turning off convergence after 0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.27579E-02   -0.31332E-02   -0.23826E-02  -273.608732652      -273.608733079      -273.608732864     0.367E-02
predicted gradient component=    0.2138409911E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3133244676E-02   0.3666341854E-02   0.4265286982E-01 after      1 steps, step: 0.0000615611
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.28020E-02   -0.32210E-02   -0.23830E-02  -273.608732648      -273.608733083      -273.608732864     0.940E-03
predicted gradient component=    0.2178699958E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3221036759E-02   0.9397199111E-03    2.725584645     after      2 steps, step: 0.0078539503
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.27160E-02   -0.32250E-02   -0.22069E-02  -273.608732651      -273.608733080      -273.608732864     0.771E-03
predicted gradient component=    0.2147709779E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3225011086E-02   0.7714916486E-03   0.1232345299     after      3 steps, step: 0.0015943605
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.27770E-02   -0.32276E-02   -0.23265E-02  -273.608732650      -273.608733081      -273.608732864     0.515E-03
predicted gradient component=    0.2154845049E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3227602118E-02   0.5152190895E-03   0.8027731026E-01 after      4 steps, step: 0.0006266776
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.27879E-02   -0.32334E-02   -0.23425E-02  -273.608732649      -273.608733082      -273.608732864     0.361E-03
predicted gradient component=    0.2165510011E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3233427450E-02   0.3609449510E-03   0.1801596401     after      5 steps, step: 0.0031102881
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.28130E-02   -0.32354E-02   -0.23906E-02  -273.608732649      -273.608733082      -273.608732864     0.280E-03
predicted gradient component=    0.2161644943E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3235351486E-02   0.2795938721E-03   0.5946916689E-01 after      6 steps, step: 0.0020394598
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.28940E-02   -0.32362E-02   -0.25518E-02  -273.608732650      -273.608733081      -273.608732864     0.533E-03
predicted gradient component=    0.2157599965E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3236214685E-02   0.5328420056E-03   0.2667308164E-01 after      7 steps, step: 0.0028623097
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.28130E-02   -0.32372E-02   -0.23887E-02  -273.608732651      -273.608733080      -273.608732864     0.154E-03
predicted gradient component=    0.2148885017E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3237199095E-02   0.1544713186E-03   0.3040931393E-01 after      8 steps, step: 0.0007981976
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.29189E-02   -0.32376E-02   -0.26002E-02  -273.608732651      -273.608733080      -273.608732864     0.134E-03
predicted gradient component=    0.2147665157E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3237572253E-02   0.1335396894E-03   0.1152586729E-01 after      9 steps, step: 0.0004769876
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.27859E-02   -0.32381E-02   -0.23337E-02  -273.608732651      -273.608733080      -273.608732864     0.208E-03
predicted gradient component=    0.2146240092E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3238107122E-02   0.2076886486E-03   0.1651794796E-01 after     10 steps, step: 0.0016174014
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.27439E-02   -0.32381E-02   -0.22498E-02  -273.608732651      -273.608733080      -273.608732864     0.322E-03
predicted gradient component=    0.2144279847E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3238104343E-02   0.3224924226E-03   0.8580881554E-04 after     11 steps, step: 0.0018578730
 xmylbfgs> Smallest eigenvalue converged in   11 steps. Eigenvalue=     -0.0032381 RMS force=      0.0003225 % change=    0.85809E-04
 xmylbfgs> Diagonal inverse Hessian elements are now         0.5348213569
beig> Overlap with previous vector=      0.9998930
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1    0.214492E-03   -0.323810E-02  0.242000E-01  0.266200E-01    0.411573E-01
 -------------------------------------------------------------------------------
 mylbfgs> Not resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6087286        0.4621663899E-03 after      0 steps
 mylbfgs> true and projected RMS:     0.4626330337E-03    0.4621663899E-03
 mylbfgs> Energy and RMS force=    -273.6087300        0.9466289783E-04 after      1 steps, step:  0.11770E-02
 mylbfgs> true and projected RMS:     0.9694312288E-04    0.9466289783E-04
 mylbfgs> Energy and RMS force=    -273.6087302        0.7432118586E-04 after      2 steps, step:  0.46597E-03
 mylbfgs> true and projected RMS:     0.7719965491E-04    0.7432118586E-04
 mylbfgs> Energy and RMS force=    -273.6087305        0.7361052363E-04 after      3 steps, step:  0.12817E-02
 mylbfgs> true and projected RMS:     0.7650467823E-04    0.7361052363E-04
 mylbfgs> Energy and RMS force=    -273.6087309        0.1004531642E-03 after      4 steps, step:  0.16943E-02
 mylbfgs> true and projected RMS:     0.1026015675E-03    0.1004531642E-03
 bfgsts> RMS grad=    0.1026015675E-03 subspace grad=    0.1004531642E-03 unscaled EF step length=    0.6595187725E-01

 BFGSTS> Beginning of optimization cycle    4.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.26960E-02   -0.29033E-02   -0.24886E-02  -273.608730738      -273.608731018      -273.608730876     0.372E-02
predicted gradient component=    0.1400189831E-03
xmylbfgs> Eigenvalue and RMS=   -0.2903301384E-02    0.3715431971E-02 after      0 steps
 xmylbfgs> Turning off convergence after 0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.27690E-02   -0.29025E-02   -0.26354E-02  -273.608730738      -273.608731018      -273.608730876     0.368E-02
predicted gradient component=    0.1400495080E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.2902464780E-02   0.3680087049E-02   0.2882390911E-01 after      1 steps, step: 0.0000621200
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.27840E-02   -0.29865E-02   -0.25814E-02  -273.608730738      -273.608731018      -273.608730876     0.827E-03
predicted gradient component=    0.1397449978E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.2986500821E-02   0.8274030564E-03    2.813862986     after      2 steps, step: 0.0071575887
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.27640E-02   -0.29902E-02   -0.25377E-02  -273.608730738      -273.608731018      -273.608730876     0.686E-03
predicted gradient component=    0.1399810117E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.2990176105E-02   0.6861875361E-03   0.1229119345     after      3 steps, step: 0.0014161876
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.28000E-02   -0.29925E-02   -0.26075E-02  -273.608730738      -273.608731018      -273.608730876     0.527E-03
predicted gradient component=    0.1400279928E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.2992495440E-02   0.5274996095E-03   0.7750504590E-01 after      4 steps, step: 0.0007276563
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.28800E-02   -0.29989E-02   -0.27611E-02  -273.608730737      -273.608731018      -273.608730876     0.304E-03
predicted gradient component=    0.1403369936E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.2998943813E-02   0.3039679539E-03   0.2150214907     after      5 steps, step: 0.0045443467
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.28029E-02   -0.29994E-02   -0.26065E-02  -273.608730737      -273.608731018      -273.608730876     0.533E-03
predicted gradient component=    0.1404475256E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.2999429873E-02   0.5328646322E-03   0.1620508532E-01 after      6 steps, step: 0.0017257949
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.28309E-02   -0.30004E-02   -0.26614E-02  -273.608730737      -273.608731018      -273.608730876     0.237E-03
predicted gradient component=    0.1405134924E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3000412064E-02   0.2366965286E-03   0.3273519210E-01 after      7 steps, step: 0.0004006829
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.28119E-02   -0.30011E-02   -0.26228E-02  -273.608730737      -273.608731018      -273.608730876     0.151E-03
predicted gradient component=    0.1406959882E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3001101683E-02   0.1505795190E-03   0.2297884475E-01 after      8 steps, step: 0.0008456707
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.27870E-02   -0.30018E-02   -0.25723E-02  -273.608730737      -273.608731019      -273.608730876     0.203E-03
predicted gradient component=    0.1408294850E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3001809697E-02   0.2027523734E-03   0.2358625717E-01 after      9 steps, step: 0.0012507997
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.27609E-02   -0.30028E-02   -0.25189E-02  -273.608730737      -273.608731019      -273.608730876     0.232E-03
predicted gradient component=    0.1409744925E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3002842983E-02   0.2321695108E-03   0.3441024461E-01 after     10 steps, step: 0.0021664148
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.28190E-02   -0.30007E-02   -0.26372E-02  -273.608730737      -273.608731019      -273.608730876     0.100E-02
predicted gradient component=    0.1409665060E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3000724648E-02   0.1004919120E-02   0.7059411397E-01 after     11 steps, step: 0.0050975653
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.27289E-02   -0.30040E-02   -0.24539E-02  -273.608730737      -273.608731019      -273.608730876     0.134E-03
predicted gradient component=    0.1409275114E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3003963012E-02   0.1342539920E-03   0.1078030635     after     12 steps, step: 0.0017734122
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.27740E-02   -0.30041E-02   -0.25438E-02  -273.608730737      -273.608731019      -273.608730876     0.986E-04
predicted gradient component=    0.1408649837E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3004118081E-02   0.9858388675E-04   0.5161899641E-02 after     13 steps, step: 0.0002572788
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.27500E-02   -0.30046E-02   -0.24953E-02  -273.608730737      -273.608731019      -273.608730876     0.114E-03
predicted gradient component=    0.1408189974E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3004637136E-02   0.1137836518E-03   0.1727510914E-01 after     14 steps, step: 0.0009228564
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.28770E-02   -0.30047E-02   -0.27492E-02  -273.608730737      -273.608731019      -273.608730876     0.135E-03
predicted gradient component=    0.1409525225E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3004737122E-02   0.1349887153E-03   0.3327623896E-02 after     15 steps, step: 0.0012293502
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.28400E-02   -0.30054E-02   -0.26746E-02  -273.608730737      -273.608731019      -273.608730876     0.259E-03
predicted gradient component=    0.1412890072E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3005411284E-02   0.2587589726E-03   0.2243161625E-01 after     16 steps, step: 0.0033760887
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.28380E-02   -0.30056E-02   -0.26703E-02  -273.608730736      -273.608731020      -273.608730876     0.266E-03
predicted gradient component=    0.1419080036E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3005649454E-02   0.2664735937E-03   0.7924051915E-02 after     17 steps, step: 0.0041378150
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.28409E-02   -0.30061E-02   -0.26757E-02  -273.608730736      -273.608731020      -273.608730876     0.740E-04
predicted gradient component=    0.1418264901E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3006091246E-02   0.7404208804E-04   0.1469658130E-01 after     18 steps, step: 0.0010862579
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.28170E-02   -0.30062E-02   -0.26279E-02  -273.608730736      -273.608731020      -273.608730876     0.619E-04
predicted gradient component=    0.1418424915E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3006209157E-02   0.6186068200E-04   0.3922245935E-02 after     19 steps, step: 0.0003646928
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.28150E-02   -0.30065E-02   -0.26235E-02  -273.608730736      -273.608731020      -273.608730876     0.659E-04
predicted gradient component=    0.1418925137E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3006547775E-02   0.6589201368E-04   0.1126266653E-01 after     20 steps, step: 0.0006205369
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.28319E-02   -0.30065E-02   -0.26573E-02  -273.608730736      -273.608731020      -273.608730876     0.193E-03
predicted gradient component=    0.1420060016E-03
xmylbfgs> Eigenvalue, RMS, % change=  -0.3006532270E-02   0.1926767045E-03   0.5156895380E-03 after     21 steps, step: 0.0012334352
 xmylbfgs> Smallest eigenvalue converged in   21 steps. Eigenvalue=     -0.0030065 RMS force=      0.0001927 % change=    0.51569E-03
 xmylbfgs> Diagonal inverse Hessian elements are now         0.9700290929
beig> Overlap with previous vector=      0.9997652
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1    0.142160E-03   -0.300653E-02  0.266200E-01  0.292820E-01    0.536082E-01
 -------------------------------------------------------------------------------
 mylbfgs> Not resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6087281        0.1057733210E-03 after      0 steps
 mylbfgs> true and projected RMS:     0.1062356880E-03    0.1057733210E-03
 mylbfgs> Energy and RMS force=    -273.6087286        0.1580099117E-03 after      1 steps, step:  0.45029E-02
 mylbfgs> true and projected RMS:     0.1582977846E-03    0.1580099117E-03
 mylbfgs> Energy and RMS force=    -273.6087291        0.1087475906E-03 after      2 steps, step:  0.23146E-02
 mylbfgs> true and projected RMS:     0.1091704266E-03    0.1087475906E-03
 mylbfgs> Energy and RMS force=    -273.6087293        0.7709698593E-04 after      3 steps, step:  0.97290E-03
 mylbfgs> true and projected RMS:     0.7771182705E-04    0.7709698593E-04
 mylbfgs> Energy and RMS force=    -273.6087295        0.7735503755E-04 after      4 steps, step:  0.15702E-02
 mylbfgs> true and projected RMS:     0.7798857121E-04    0.7735503755E-04
 bfgsts> RMS grad=    0.7798857121E-04 subspace grad=    0.7735503755E-04 unscaled EF step length=    0.4717848098E-01

 BFGSTS> Beginning of optimization cycle    5.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.24920E-02   -0.25727E-02   -0.24113E-02  -273.608729475      -273.608729607      -273.608729540     0.407E-02
predicted gradient component=    0.6646098427E-04
xmylbfgs> Eigenvalue and RMS=   -0.2572711785E-02    0.4071307878E-02 after      0 steps
 xmylbfgs> Turning off convergence after 0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.24301E-02   -0.25719E-02   -0.22882E-02  -273.608729475      -273.608729607      -273.608729540     0.403E-02
predicted gradient component=    0.6648102158E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.2571925452E-02   0.4029365052E-02   0.3057370536E-01 after      1 steps, step: 0.0000745900
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25431E-02   -0.26730E-02   -0.24131E-02  -273.608729475      -273.608729607      -273.608729540     0.835E-03
predicted gradient component=    0.6606350667E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.2673018053E-02   0.8346041013E-03    3.781964770     after      2 steps, step: 0.0078751893
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.24589E-02   -0.26772E-02   -0.22406E-02  -273.608729475      -273.608729607      -273.608729540     0.689E-03
predicted gradient component=    0.6611551839E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.2677232309E-02   0.6891016528E-03   0.1574108918     after      3 steps, step: 0.0014160222
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25650E-02   -0.26801E-02   -0.24499E-02  -273.608729475      -273.608729607      -273.608729540     0.584E-03
predicted gradient component=    0.6613549886E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.2680143675E-02   0.5844603150E-03   0.1086272470     after      4 steps, step: 0.0009921271
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.26099E-02   -0.26864E-02   -0.25334E-02  -273.608729475      -273.608729607      -273.608729540     0.870E-03
predicted gradient component=    0.6564900445E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.2686401049E-02   0.8703620434E-03   0.2329277760     after      5 steps, step: 0.0066248804
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25890E-02   -0.26883E-02   -0.24897E-02  -273.608729475      -273.608729607      -273.608729540     0.675E-03
predicted gradient component=    0.6595848845E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.2688291749E-02   0.6749336962E-03   0.7033089006E-01 after      6 steps, step: 0.0021665893
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25100E-02   -0.26900E-02   -0.23300E-02  -273.608729475      -273.608729607      -273.608729540     0.203E-03
predicted gradient component=    0.6589300483E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.2690005479E-02   0.2025753623E-03   0.6370730410E-01 after      7 steps, step: 0.0013333241
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25981E-02   -0.26905E-02   -0.25057E-02  -273.608729475      -273.608729607      -273.608729540     0.158E-03
predicted gradient component=    0.6586500945E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.2690466242E-02   0.1584031624E-03   0.1712576712E-01 after      8 steps, step: 0.0003680514
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25810E-02   -0.26919E-02   -0.24701E-02  -273.608729475      -273.608729607      -273.608729540     0.203E-03
predicted gradient component=    0.6577150202E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.2691918855E-02   0.2029720896E-03   0.5396198972E-01 after      9 steps, step: 0.0023631208
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.24820E-02   -0.26923E-02   -0.22718E-02  -273.608729475      -273.608729607      -273.608729540     0.389E-03
predicted gradient component=    0.6582700962E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.2692270325E-02   0.3887982826E-03   0.1305479356E-01 after     10 steps, step: 0.0018467997
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.24670E-02   -0.26930E-02   -0.22410E-02  -273.608729475      -273.608729607      -273.608729540     0.150E-03
predicted gradient component=    0.6584150469E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.2692989477E-02   0.1504894786E-03   0.2670461488E-01 after     11 steps, step: 0.0008614454
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25640E-02   -0.26932E-02   -0.24347E-02  -273.608729475      -273.608729607      -273.608729540     0.878E-04
predicted gradient component=    0.6583999834E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.2693247243E-02   0.8777499824E-04   0.9570820978E-02 after     12 steps, step: 0.0006826831
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.24939E-02   -0.26934E-02   -0.22945E-02  -273.608729475      -273.608729607      -273.608729540     0.100E-03
predicted gradient component=    0.6585500500E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.2693402805E-02   0.1002615215E-03   0.5775644577E-02 after     13 steps, step: 0.0005911173
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.24889E-02   -0.26937E-02   -0.22842E-02  -273.608729475      -273.608729607      -273.608729540     0.113E-03
predicted gradient component=    0.6581947787E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.2693731621E-02   0.1128575966E-03   0.1220673467E-01 after     14 steps, step: 0.0011685910
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.24170E-02   -0.26940E-02   -0.21400E-02  -273.608729475      -273.608729607      -273.608729540     0.291E-03
predicted gradient component=    0.6561049304E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.2694001740E-02   0.2906070112E-03   0.1002668880E-01 after     15 steps, step: 0.0031806723
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25269E-02   -0.26946E-02   -0.23592E-02  -273.608729476      -273.608729606      -273.608729540     0.155E-03
predicted gradient component=    0.6540651043E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.2694637977E-02   0.1554120187E-03   0.2361119091E-01 after     16 steps, step: 0.0027400705
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25340E-02   -0.26949E-02   -0.23731E-02  -273.608729476      -273.608729606      -273.608729540     0.804E-04
predicted gradient component=    0.6536700425E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.2694862358E-02   0.8035042881E-04   0.8326254861E-02 after     17 steps, step: 0.0006005845
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25160E-02   -0.26951E-02   -0.23369E-02  -273.608729476      -273.608729606      -273.608729540     0.753E-04
predicted gradient component=    0.6529899110E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.2695144172E-02   0.7526296892E-04   0.1045638161E-01 after     18 steps, step: 0.0011379732
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.24951E-02   -0.26953E-02   -0.22949E-02  -273.608729476      -273.608729606      -273.608729540     0.125E-03
predicted gradient component=    0.6535148600E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.2695294618E-02   0.1254919777E-03   0.5581789530E-02 after     19 steps, step: 0.0015069608
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25310E-02   -0.26953E-02   -0.23667E-02  -273.608729476      -273.608729606      -273.608729540     0.806E-04
predicted gradient component=    0.6540147979E-04
xmylbfgs> Eigenvalue, RMS, % change=  -0.2695320413E-02   0.8060560381E-04   0.9570229391E-03 after     20 steps, step: 0.0006289677
 xmylbfgs> Smallest eigenvalue converged in   20 steps. Eigenvalue=     -0.0026953 RMS force=      0.0000806 % change=    0.95702E-03
 xmylbfgs> Diagonal inverse Hessian elements are now         0.3199481928
beig> Overlap with previous vector=      0.9997647
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1    0.654413E-04   -0.269532E-02  0.242653E-01  0.300000E-01    0.538921E-01
 -------------------------------------------------------------------------------
 mylbfgs> Not resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6087287        0.8187631351E-04 after      0 steps
 mylbfgs> true and projected RMS:     0.8187803649E-04    0.8187631351E-04
 mylbfgs> Energy and RMS force=    -273.6087289        0.8096825330E-04 after      1 steps, step:  0.20471E-02
 mylbfgs> true and projected RMS:     0.8096885376E-04    0.8096825330E-04
 mylbfgs> Energy and RMS force=    -273.6087291        0.6310694367E-04 after      2 steps, step:  0.13600E-02
 mylbfgs> true and projected RMS:     0.6310758420E-04    0.6310694367E-04
 mylbfgs> Energy and RMS force=    -273.6087294        0.9249978847E-04 after      3 steps, step:  0.25677E-02
 mylbfgs> true and projected RMS:     0.9249998260E-04    0.9249978847E-04
 mylbfgs> Energy and RMS force=    -273.6087295        0.1152154838E-03 after      4 steps, step:  0.24892E-02
 mylbfgs> true and projected RMS:     0.1152157431E-03    0.1152154838E-03
 bfgsts> RMS grad=    0.1152157431E-03 subspace grad=    0.1152154838E-03 unscaled EF step length=    0.2426529209E-01

 BFGSTS> Beginning of optimization cycle    6.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25210E-02   -0.24062E-02   -0.26358E-02  -273.608729480      -273.608729483      -273.608729480     0.350E-02
predicted gradient component=    0.1538495553E-05
xmylbfgs> Eigenvalue and RMS=   -0.2406192235E-02    0.3496339973E-02 after      0 steps
 xmylbfgs> Turning off convergence after 0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.24071E-02   -0.24044E-02   -0.24098E-02  -273.608729480      -273.608729483      -273.608729480     0.347E-02
predicted gradient component=    0.1579479658E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2404403192E-02   0.3465944905E-02   0.7440696666E-01 after      1 steps, step: 0.0000550098
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.26321E-02   -0.24795E-02   -0.27847E-02  -273.608729480      -273.608729483      -273.608729480     0.909E-03
predicted gradient component=    0.1757996415E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2479474293E-02   0.9090931306E-03    3.027702356     after      2 steps, step: 0.0070695128
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25701E-02   -0.24832E-02   -0.26570E-02  -273.608729479      -273.608729483      -273.608729480     0.715E-03
predicted gradient component=    0.1939980621E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2483191959E-02   0.7149664523E-03   0.1497131664     after      3 steps, step: 0.0014810914
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25110E-02   -0.24853E-02   -0.25367E-02  -273.608729479      -273.608729483      -273.608729480     0.489E-03
predicted gradient component=    0.1938502692E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2485278056E-02   0.4892855534E-03   0.8393819775E-01 after      4 steps, step: 0.0005843052
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25331E-02   -0.24906E-02   -0.25755E-02  -273.608729479      -273.608729483      -273.608729480     0.329E-03
predicted gradient component=    0.2007482180E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2490629307E-02   0.3294979352E-03   0.2148553709     after      5 steps, step: 0.0030800227
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25531E-02   -0.24922E-02   -0.26139E-02  -273.608729479      -273.608729483      -273.608729480     0.253E-03
predicted gradient component=    0.2098488494E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2492244435E-02   0.2527577341E-03   0.6480615810E-01 after      6 steps, step: 0.0017810193
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25831E-02   -0.24930E-02   -0.26731E-02  -273.608729479      -273.608729484      -273.608729480     0.476E-03
predicted gradient component=    0.2351498551E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2493020378E-02   0.4764213858E-03   0.3112460640E-01 after      7 steps, step: 0.0027699886
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25191E-02   -0.24938E-02   -0.25443E-02  -273.608729479      -273.608729483      -273.608729480     0.161E-03
predicted gradient component=    0.2224510354E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2493834148E-02   0.1605168798E-03   0.3263128510E-01 after      8 steps, step: 0.0008998978
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25540E-02   -0.24943E-02   -0.26136E-02  -273.608729479      -273.608729483      -273.608729480     0.124E-03
predicted gradient component=    0.2214989081E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2494337033E-02   0.1239411390E-03   0.2016107499E-01 after      9 steps, step: 0.0004267205
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25410E-02   -0.24948E-02   -0.25872E-02  -273.608729479      -273.608729483      -273.608729480     0.155E-03
predicted gradient component=    0.2058499149E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2494791011E-02   0.1553066770E-03   0.1819704552E-01 after     10 steps, step: 0.0013285157
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.26361E-02   -0.24950E-02   -0.27771E-02  -273.608729479      -273.608729483      -273.608729480     0.280E-03
predicted gradient component=    0.2127023890E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2494966779E-02   0.2799679949E-03   0.7044895481E-02 after     11 steps, step: 0.0018405896
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25231E-02   -0.24955E-02   -0.25507E-02  -273.608729479      -273.608729483      -273.608729480     0.845E-04
predicted gradient component=    0.2034482804E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2495450302E-02   0.8445870868E-04   0.1937617006E-01 after     12 steps, step: 0.0003871257
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.26240E-02   -0.24953E-02   -0.27527E-02  -273.608729479      -273.608729483      -273.608729480     0.622E-04
predicted gradient component=    0.2052018999E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2495262674E-02   0.6218922720E-04   0.7519353786E-02 after     13 steps, step: 0.0002915946
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25251E-02   -0.24953E-02   -0.25549E-02  -273.608729479      -273.608729483      -273.608729480     0.772E-04
predicted gradient component=    0.2016491862E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2495312955E-02   0.7719104106E-04   0.2015030665E-02 after     14 steps, step: 0.0005078445
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25341E-02   -0.24954E-02   -0.25728E-02  -273.608729479      -273.608729483      -273.608729480     0.996E-04
predicted gradient component=    0.1985995368E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2495371573E-02   0.9961157864E-04   0.2349047627E-02 after     15 steps, step: 0.0010434495
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25080E-02   -0.24957E-02   -0.25204E-02  -273.608729479      -273.608729483      -273.608729480     0.277E-03
predicted gradient component=    0.1916021120E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2495738871E-02   0.2770861227E-03   0.1471699743E-01 after     16 steps, step: 0.0023997022
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.26140E-02   -0.24961E-02   -0.27319E-02  -273.608729480      -273.608729483      -273.608729480     0.954E-04
predicted gradient component=    0.1800998461E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2496066998E-02   0.9536116640E-04   0.1314575307E-01 after     17 steps, step: 0.0011854177
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.26221E-02   -0.24964E-02   -0.27477E-02  -273.608729480      -273.608729483      -273.608729480     0.642E-04
predicted gradient component=    0.1749015155E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2496421218E-02   0.6420506364E-04   0.1418913010E-01 after     18 steps, step: 0.0005213615
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25950E-02   -0.24963E-02   -0.26937E-02  -273.608729480      -273.608729483      -273.608729480     0.604E-04
predicted gradient component=    0.1613500444E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2496328737E-02   0.6037174849E-04   0.3704664112E-02 after     19 steps, step: 0.0009478081
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.26240E-02   -0.24962E-02   -0.27518E-02  -273.608729480      -273.608729483      -273.608729480     0.894E-04
predicted gradient component=    0.1493987156E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2496193461E-02   0.8936342405E-04   0.5419326312E-02 after     20 steps, step: 0.0009700361
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.24960E-02   -0.24964E-02   -0.24956E-02  -273.608729480      -273.608729483      -273.608729480     0.457E-04
predicted gradient component=    0.1345000555E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2496437050E-02   0.4570405142E-04   0.9757477127E-02 after     21 steps, step: 0.0007830470
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.26081E-02   -0.24965E-02   -0.27197E-02  -273.608729480      -273.608729483      -273.608729480     0.439E-04
predicted gradient component=    0.1284007567E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2496465994E-02   0.4393434972E-04   0.1159394807E-02 after     22 steps, step: 0.0002014430
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.26071E-02   -0.24968E-02   -0.27174E-02  -273.608729480      -273.608729483      -273.608729480     0.708E-04
predicted gradient component=    0.1282501216E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2496760753E-02   0.7083464609E-04   0.1180565116E-01 after     23 steps, step: 0.0007986381
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.26051E-02   -0.24964E-02   -0.27138E-02  -273.608729480      -273.608729482      -273.608729480     0.104E-03
predicted gradient component=    0.1197491883E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2496427745E-02   0.1036279158E-03   0.1333938027E-01 after     24 steps, step: 0.0010009295
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.26031E-02   -0.24967E-02   -0.27095E-02  -273.608729480      -273.608729483      -273.608729480     0.558E-04
predicted gradient component=    0.1218495527E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2496697733E-02   0.5577640162E-04   0.1081383995E-01 after     25 steps, step: 0.0003925675
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25990E-02   -0.24968E-02   -0.27012E-02  -273.608729480      -273.608729482      -273.608729480     0.379E-04
predicted gradient component=    0.1171514441E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2496804031E-02   0.3790332579E-04   0.4257358404E-02 after     26 steps, step: 0.0006986667
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.26101E-02   -0.24966E-02   -0.27237E-02  -273.608729480      -273.608729482      -273.608729480     0.456E-04
predicted gradient component=    0.1133997785E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2496605402E-02   0.4563988989E-04   0.7955977251E-02 after     27 steps, step: 0.0003099830
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25670E-02   -0.24970E-02   -0.26371E-02  -273.608729480      -273.608729482      -273.608729480     0.853E-04
predicted gradient component=    0.1001524197E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2497014839E-02   0.8525079042E-04   0.1639706011E-01 after     28 steps, step: 0.0020696646
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.26090E-02   -0.24971E-02   -0.27209E-02  -273.608729481      -273.608729482      -273.608729480     0.103E-03
predicted gradient component=    0.7924825240E-06
xmylbfgs> Eigenvalue, RMS, % change=  -0.2497057530E-02   0.1027002472E-03   0.1709664502E-02 after     29 steps, step: 0.0024860245
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25631E-02   -0.24969E-02   -0.26293E-02  -273.608729481      -273.608729482      -273.608729480     0.294E-03
predicted gradient component=    0.4494893346E-06
xmylbfgs> Eigenvalue, RMS, % change=  -0.2496860955E-02   0.2941807000E-03   0.7872902639E-02 after     30 steps, step: 0.0051994283
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25860E-02   -0.24973E-02   -0.26748E-02  -273.608729481      -273.608729482      -273.608729480     0.673E-04
predicted gradient component=    0.4740172699E-06
xmylbfgs> Eigenvalue, RMS, % change=  -0.2497250353E-02   0.6734494061E-04   0.1559306353E-01 after     31 steps, step: 0.0006629735
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25921E-02   -0.24974E-02   -0.26868E-02  -273.608729481      -273.608729482      -273.608729480     0.327E-04
predicted gradient component=    0.4050093594E-06
xmylbfgs> Eigenvalue, RMS, % change=  -0.2497361840E-02   0.3268708673E-04   0.4464203037E-02 after     32 steps, step: 0.0003019782
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25681E-02   -0.24976E-02   -0.26386E-02  -273.608729481      -273.608729482      -273.608729480     0.302E-04
predicted gradient component=    0.4110063401E-06
xmylbfgs> Eigenvalue, RMS, % change=  -0.2497577642E-02   0.3022845451E-04   0.8640460713E-02 after     33 steps, step: 0.0004122391
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25821E-02   -0.24973E-02   -0.26668E-02  -273.608729481      -273.608729482      -273.608729480     0.385E-04
predicted gradient component=    0.3819877747E-06
xmylbfgs> Eigenvalue, RMS, % change=  -0.2497327013E-02   0.3848300286E-04   0.1003588373E-01 after     34 steps, step: 0.0004178144
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.26031E-02   -0.24974E-02   -0.27088E-02  -273.608729481      -273.608729482      -273.608729480     0.518E-04
predicted gradient component=    0.2604849669E-06
xmylbfgs> Eigenvalue, RMS, % change=  -0.2497414143E-02   0.5181422312E-04   0.3488796536E-02 after     35 steps, step: 0.0015611409
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25591E-02   -0.24971E-02   -0.26211E-02  -273.608729481      -273.608729481      -273.608729480     0.187E-03
predicted gradient component=    0.6349409887E-07
xmylbfgs> Eigenvalue, RMS, % change=  -0.2497095355E-02   0.1874340935E-03   0.1276634705E-01 after     36 steps, step: 0.0019526389
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25869E-02   -0.24977E-02   -0.26762E-02  -273.608729481      -273.608729481      -273.608729480     0.276E-04
predicted gradient component=    0.1334967692E-06
xmylbfgs> Eigenvalue, RMS, % change=  -0.2497697371E-02   0.2764347815E-04   0.2410284099E-01 after     37 steps, step: 0.0009088600
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25871E-02   -0.24975E-02   -0.26766E-02  -273.608729481      -273.608729481      -273.608729480     0.166E-04
predicted gradient component=    0.1595026333E-06
xmylbfgs> Eigenvalue, RMS, % change=  -0.2497473743E-02   0.1664737343E-04   0.8954195663E-02 after     38 steps, step: 0.0000898616
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25540E-02   -0.24975E-02   -0.26105E-02  -273.608729481      -273.608729481      -273.608729480     0.171E-04
predicted gradient component=    0.2139870503E-06
xmylbfgs> Eigenvalue, RMS, % change=  -0.2497481264E-02   0.1706970168E-04   0.3011654265E-03 after     39 steps, step: 0.0002515466
 xmylbfgs> Smallest eigenvalue converged in   39 steps. Eigenvalue=     -0.0024975 RMS force=      0.0000171 % change=    0.30117E-03
 xmylbfgs> Diagonal inverse Hessian elements are now         0.3819306118
beig> Overlap with previous vector=      0.9996523
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1    0.231112E-06   -0.249748E-02  0.925382E-04  0.300000E-01    0.177254E-01
 -------------------------------------------------------------------------------
 mylbfgs> Not resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6087295        0.1152181195E-03 after      0 steps
 mylbfgs> true and projected RMS:     0.1152181195E-03    0.1152181195E-03
 mylbfgs> Energy and RMS force=    -273.6087296        0.4722965043E-04 after      1 steps, step:  0.38001E-03
 mylbfgs> true and projected RMS:     0.4722965044E-04    0.4722965043E-04
 mylbfgs> Energy and RMS force=    -273.6087297        0.3331240935E-04 after      2 steps, step:  0.66017E-03
 mylbfgs> true and projected RMS:     0.3331240958E-04    0.3331240935E-04
 mylbfgs> Energy and RMS force=    -273.6087297        0.2911148775E-04 after      3 steps, step:  0.68540E-03
 mylbfgs> true and projected RMS:     0.2911148826E-04    0.2911148775E-04
 mylbfgs> Energy and RMS force=    -273.6087298        0.5416909659E-04 after      4 steps, step:  0.14190E-02
 mylbfgs> true and projected RMS:     0.5416909659E-04    0.5416909659E-04
 bfgsts> RMS grad=    0.5416909659E-04 subspace grad=    0.5416909659E-04 unscaled EF step length=    0.9253822885E-04

 BFGSTS> Beginning of optimization cycle    7.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.24750E-02   -0.24600E-02   -0.24899E-02  -273.608729813      -273.608729813      -273.608729812     0.135E-03
predicted gradient component=   -0.1084856649E-06
xmylbfgs> Eigenvalue and RMS=   -0.2459994068E-02    0.1350472859E-03 after      0 steps
 xmylbfgs> Turning off convergence after 0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.24190E-02   -0.24576E-02   -0.23804E-02  -273.608729813      -273.608729813      -273.608729812     0.134E-03
predicted gradient component=   -0.6150457921E-07
xmylbfgs> Eigenvalue, RMS, % change=  -0.2457611921E-02   0.1339832326E-03   0.9692937580E-01 after      1 steps, step: 0.0000000821
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.24161E-02   -0.24576E-02   -0.23745E-02  -273.608729813      -273.608729813      -273.608729812     0.121E-03
predicted gradient component=   -0.6500044947E-07
xmylbfgs> Eigenvalue, RMS, % change=  -0.2457635546E-02   0.1205638294E-03   0.9613036020E-03 after      2 steps, step: 0.0000189767
 xmylbfgs> Smallest eigenvalue converged in    2 steps. Eigenvalue=     -0.0024576 RMS force=      0.0001206 % change=    0.96130E-03
 xmylbfgs> Diagonal inverse Hessian elements are now         0.0006831753
beig> Overlap with previous vector=      1.0000000
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1   -0.603737E-08   -0.245764E-02 -0.245658E-05  0.272727E-01    0.839742E+00
 -------------------------------------------------------------------------------
 mylbfgs> Not resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6087298        0.5415877532E-04 after      0 steps
 mylbfgs> true and projected RMS:     0.5415877532E-04    0.5415877532E-04
 mylbfgs> Energy and RMS force=    -273.6087299        0.4324550393E-04 after      1 steps, step:  0.17872E-02
 mylbfgs> true and projected RMS:     0.4324550421E-04    0.4324550393E-04
 mylbfgs> Energy and RMS force=    -273.6087300        0.5008756606E-04 after      2 steps, step:  0.17506E-02
 mylbfgs> true and projected RMS:     0.5008756627E-04    0.5008756606E-04
 mylbfgs> Energy and RMS force=    -273.6087301        0.1018554195E-03 after      3 steps, step:  0.44707E-02
 mylbfgs> true and projected RMS:     0.1018554195E-03    0.1018554195E-03
 mylbfgs> Energy and RMS force=    -273.6087302        0.3447239770E-04 after      4 steps, step:  0.89059E-03
 mylbfgs> true and projected RMS:     0.3447239931E-04    0.3447239770E-04
 mylbfgs> Energy and RMS force=    -273.6087303        0.3213861953E-04 after      5 steps, step:  0.43398E-03
 mylbfgs> true and projected RMS:     0.3213862090E-04    0.3213861953E-04
 mylbfgs> Energy and RMS force=    -273.6087304        0.4779000619E-04 after      6 steps, step:  0.11676E-02
 mylbfgs> true and projected RMS:     0.4779000721E-04    0.4779000619E-04
 mylbfgs> Energy and RMS force=    -273.6087306        0.7200665421E-04 after      7 steps, step:  0.31250E-02
 mylbfgs> true and projected RMS:     0.7200665440E-04    0.7200665421E-04
 mylbfgs> Energy and RMS force=    -273.6087309        0.1081274430E-03 after      8 steps, step:  0.80447E-02
 mylbfgs> true and projected RMS:     0.1081274745E-03    0.1081274430E-03
 mylbfgs> Energy and RMS force=    -273.6087312        0.7362364925E-04 after      9 steps, step:  0.69470E-02
 mylbfgs> true and projected RMS:     0.7362368217E-04    0.7362364925E-04
 mylbfgs> Energy and RMS force=    -273.6087313        0.3737286318E-04 after     10 steps, step:  0.21813E-02
 mylbfgs> true and projected RMS:     0.3737288549E-04    0.3737286318E-04
 bfgsts> RMS grad=    0.3737288549E-04 subspace grad=    0.3737286318E-04 unscaled EF step length=    0.2456576399E-05

 BFGSTS> Beginning of optimization cycle    8.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25909E-02   -0.25301E-02   -0.26518E-02  -273.608731309      -273.608731309      -273.608731308     0.159E-02
predicted gradient component=    0.1705018349E-06
xmylbfgs> Eigenvalue and RMS=   -0.2530080424E-02    0.1593364243E-02 after      0 steps
 xmylbfgs> Turning off convergence after 0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25830E-02   -0.25279E-02   -0.26380E-02  -273.608731309      -273.608731309      -273.608731308     0.159E-02
predicted gradient component=    0.1854800757E-06
xmylbfgs> Eigenvalue, RMS, % change=  -0.2527892749E-02   0.1586800615E-02   0.8654146528E-01 after      1 steps, step: 0.0000114246
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25930E-02   -0.25371E-02   -0.26489E-02  -273.608731309      -273.608731309      -273.608731308     0.127E-02
predicted gradient component=   -0.1425064511E-06
xmylbfgs> Eigenvalue, RMS, % change=  -0.2537051433E-02   0.1274958783E-02   0.3609971730     after      2 steps, step: 0.0038958841
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.26130E-02   -0.25430E-02   -0.26829E-02  -273.608731309      -273.608731309      -273.608731308     0.245E-03
predicted gradient component=    0.5115907697E-09
xmylbfgs> Eigenvalue, RMS, % change=  -0.2543034053E-02   0.2445263408E-03   0.2352552039     after      3 steps, step: 0.0014318018
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25959E-02   -0.25433E-02   -0.26485E-02  -273.608731309      -273.608731309      -273.608731308     0.159E-03
predicted gradient component=    0.3012701200E-08
xmylbfgs> Eigenvalue, RMS, % change=  -0.2543343126E-02   0.1587812271E-03   0.1215222797E-01 after      4 steps, step: 0.0002496860
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.26180E-02   -0.25438E-02   -0.26922E-02  -273.608731309      -273.608731309      -273.608731308     0.129E-03
predicted gradient component=    0.6991740520E-08
xmylbfgs> Eigenvalue, RMS, % change=  -0.2543792198E-02   0.1285834899E-03   0.1765366322E-01 after      5 steps, step: 0.0006390624
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.26430E-02   -0.25441E-02   -0.27418E-02  -273.608731309      -273.608731309      -273.608731308     0.149E-03
predicted gradient component=   -0.6508571460E-08
xmylbfgs> Eigenvalue, RMS, % change=  -0.2544141506E-02   0.1485305623E-03   0.1372990190E-01 after      6 steps, step: 0.0006865336
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.26280E-02   -0.25442E-02   -0.27118E-02  -273.608731309      -273.608731309      -273.608731308     0.145E-03
predicted gradient component=     0.000000000    
xmylbfgs> Eigenvalue, RMS, % change=  -0.2544194537E-02   0.1447563671E-03   0.2084401636E-02 after      7 steps, step: 0.0010054625
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.26130E-02   -0.25443E-02   -0.26816E-02  -273.608731309      -273.608731309      -273.608731308     0.505E-04
predicted gradient component=   -0.5849187801E-07
xmylbfgs> Eigenvalue, RMS, % change=  -0.2544331227E-02   0.5054226242E-04   0.5372316275E-02 after      8 steps, step: 0.0001948729
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.26130E-02   -0.25444E-02   -0.26815E-02  -273.608731309      -273.608731309      -273.608731308     0.460E-04
predicted gradient component=   -0.3549871508E-07
xmylbfgs> Eigenvalue, RMS, % change=  -0.2544418049E-02   0.4597046046E-04   0.3412267159E-02 after      9 steps, step: 0.0001249469
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.26080E-02   -0.25445E-02   -0.26714E-02  -273.608731309      -273.608731309      -273.608731308     0.497E-04
predicted gradient component=   -0.6298250810E-07
xmylbfgs> Eigenvalue, RMS, % change=  -0.2544508699E-02   0.4970094408E-04   0.3562563107E-02 after     10 steps, step: 0.0003142412
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.26089E-02   -0.25445E-02   -0.26733E-02  -273.608731309      -273.608731309      -273.608731308     0.103E-03
predicted gradient component=   -0.7250378076E-07
xmylbfgs> Eigenvalue, RMS, % change=  -0.2544482455E-02   0.1027255361E-03   0.1031412452E-02 after     11 steps, step: 0.0005624755
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.26230E-02   -0.25445E-02   -0.27015E-02  -273.608731309      -273.608731309      -273.608731308     0.347E-04
predicted gradient component=   -0.4050093594E-07
xmylbfgs> Eigenvalue, RMS, % change=  -0.2544513003E-02   0.3473512182E-04   0.1200556111E-02 after     12 steps, step: 0.0002041483
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25940E-02   -0.25446E-02   -0.26434E-02  -273.608731309      -273.608731309      -273.608731308     0.212E-04
predicted gradient component=   -0.6900791050E-07
xmylbfgs> Eigenvalue, RMS, % change=  -0.2544604416E-02   0.2120090935E-04   0.3592399648E-02 after     13 steps, step: 0.0000904747
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.26020E-02   -0.25446E-02   -0.26593E-02  -273.608731309      -273.608731309      -273.608731308     0.229E-04
predicted gradient component=   -0.1030002750E-06
xmylbfgs> Eigenvalue, RMS, % change=  -0.2544592546E-02   0.2293339419E-04   0.4664586362E-03 after     14 steps, step: 0.0001564156
 xmylbfgs> Smallest eigenvalue converged in   14 steps. Eigenvalue=     -0.0025446 RMS force=      0.0000229 % change=    0.46646E-03
 xmylbfgs> Diagonal inverse Hessian elements are now         0.2797620276
beig> Overlap with previous vector=      0.9999895
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1   -0.642413E-07   -0.254459E-02 -0.252462E-04  0.300000E-01    0.135712E+00
 -------------------------------------------------------------------------------
 mylbfgs> Not resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6087313        0.3737381230E-04 after      0 steps
 mylbfgs> true and projected RMS:     0.3737381232E-04    0.3737381230E-04
 mylbfgs> Energy and RMS force=    -273.6087314        0.3276418979E-04 after      1 steps, step:  0.18694E-02
 mylbfgs> true and projected RMS:     0.3276418980E-04    0.3276418979E-04
 mylbfgs> Energy and RMS force=    -273.6087314        0.4089106135E-04 after      2 steps, step:  0.11390E-02
 mylbfgs> true and projected RMS:     0.4089106138E-04    0.4089106135E-04
 mylbfgs> Energy and RMS force=    -273.6087315        0.4440829025E-04 after      3 steps, step:  0.26590E-02
 mylbfgs> true and projected RMS:     0.4440829028E-04    0.4440829025E-04
 mylbfgs> Energy and RMS force=    -273.6087317        0.5162818322E-04 after      4 steps, step:  0.45168E-02
 mylbfgs> true and projected RMS:     0.5162818330E-04    0.5162818322E-04
 mylbfgs> Energy and RMS force=    -273.6087319        0.3277316480E-04 after      5 steps, step:  0.43228E-02
 mylbfgs> true and projected RMS:     0.3277316767E-04    0.3277316480E-04
 mylbfgs> Energy and RMS force=    -273.6087319        0.3055248493E-04 after      6 steps, step:  0.16004E-02
 mylbfgs> true and projected RMS:     0.3055248636E-04    0.3055248493E-04
 mylbfgs> Energy and RMS force=    -273.6087320        0.3176722768E-04 after      7 steps, step:  0.12618E-02
 mylbfgs> true and projected RMS:     0.3176723190E-04    0.3176722768E-04
 mylbfgs> Energy and RMS force=    -273.6087321        0.3817583655E-04 after      8 steps, step:  0.22342E-02
 mylbfgs> true and projected RMS:     0.3817583835E-04    0.3817583655E-04
 mylbfgs> Energy and RMS force=    -273.6087322        0.3729032155E-04 after      9 steps, step:  0.32977E-02
 mylbfgs> true and projected RMS:     0.3729034034E-04    0.3729032155E-04
 mylbfgs> Energy and RMS force=    -273.6087322        0.1901675814E-04 after     10 steps, step:  0.66698E-03
 mylbfgs> true and projected RMS:     0.1901678098E-04    0.1901675814E-04
 bfgsts> RMS grad=    0.1901678098E-04 subspace grad=    0.1901675814E-04 unscaled EF step length=    0.2524618460E-04

 BFGSTS> Beginning of optimization cycle    9.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.24939E-02   -0.25480E-02   -0.24399E-02  -273.608732199      -273.608732200      -273.608732198     0.710E-03
predicted gradient component=    0.1549835815E-06
xmylbfgs> Eigenvalue and RMS=   -0.2547999767E-02    0.7096571560E-03 after      0 steps
 xmylbfgs> Turning off convergence after 0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.24720E-02   -0.25454E-02   -0.23987E-02  -273.608732199      -273.608732200      -273.608732198     0.708E-03
predicted gradient component=    0.1580247044E-06
xmylbfgs> Eigenvalue, RMS, % change=  -0.2545360431E-02   0.7078585764E-03   0.1036920097     after      1 steps, step: 0.0000022663
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25981E-02   -0.25470E-02   -0.26492E-02  -273.608732199      -273.608732200      -273.608732198     0.520E-03
predicted gradient component=    0.1309956588E-06
xmylbfgs> Eigenvalue, RMS, % change=  -0.2546964688E-02   0.5200826953E-03   0.6298700340E-01 after      2 steps, step: 0.0016717103
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25650E-02   -0.25480E-02   -0.25820E-02  -273.608732199      -273.608732200      -273.608732198     0.131E-03
predicted gradient component=    0.1394937499E-06
xmylbfgs> Eigenvalue, RMS, % change=  -0.2547955222E-02   0.1312260119E-03   0.3887563528E-01 after      3 steps, step: 0.0005807517
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.24950E-02   -0.25480E-02   -0.24419E-02  -273.608732199      -273.608732200      -273.608732198     0.896E-04
predicted gradient component=    0.1274997885E-06
xmylbfgs> Eigenvalue, RMS, % change=  -0.2548049737E-02   0.8959493135E-04   0.3709323601E-02 after      4 steps, step: 0.0001254884
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.25860E-02   -0.25482E-02   -0.26239E-02  -273.608732199      -273.608732200      -273.608732198     0.738E-04
predicted gradient component=    0.1039950348E-06
xmylbfgs> Eigenvalue, RMS, % change=  -0.2548182093E-02   0.7383962002E-04   0.5194130810E-02 after      5 steps, step: 0.0003405835
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.26140E-02   -0.25484E-02   -0.26796E-02  -273.608732199      -273.608732200      -273.608732198     0.652E-04
predicted gradient component=    0.1530224836E-06
xmylbfgs> Eigenvalue, RMS, % change=  -0.2548423385E-02   0.6518871155E-04   0.9468268180E-02 after      6 steps, step: 0.0004218306
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.24960E-02   -0.25484E-02   -0.24436E-02  -273.608732199      -273.608732199      -273.608732198     0.686E-04
predicted gradient component=    0.6599520930E-07
xmylbfgs> Eigenvalue, RMS, % change=  -0.2548416779E-02   0.6863040970E-04   0.2592206580E-03 after      7 steps, step: 0.0006647526
 xmylbfgs> Smallest eigenvalue converged in    7 steps. Eigenvalue=     -0.0025484 RMS force=      0.0000686 % change=    0.25922E-03
 xmylbfgs> Diagonal inverse Hessian elements are now         1.0859547599
beig> Overlap with previous vector=      0.9999978
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1    0.118962E-06   -0.254842E-02  0.466807E-04  0.300000E-01    0.448029E-01
 -------------------------------------------------------------------------------
 mylbfgs> Not resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6087322        0.1901720590E-04 after      0 steps
 mylbfgs> true and projected RMS:     0.1901720592E-04    0.1901720590E-04
 mylbfgs> Energy and RMS force=    -273.6087322        0.2122180017E-04 after      1 steps, step:  0.90461E-03
 mylbfgs> true and projected RMS:     0.2122180026E-04    0.2122180017E-04
 mylbfgs> Energy and RMS force=    -273.6087323        0.2998000942E-04 after      2 steps, step:  0.19827E-02
 mylbfgs> true and projected RMS:     0.2998000956E-04    0.2998000942E-04
 mylbfgs> Energy and RMS force=    -273.6087324        0.3792234014E-04 after      3 steps, step:  0.45531E-02
 mylbfgs> true and projected RMS:     0.3792234659E-04    0.3792234014E-04
 mylbfgs> Energy and RMS force=    -273.6087325        0.7194251585E-04 after      4 steps, step:  0.68810E-02
 mylbfgs> true and projected RMS:     0.7194252033E-04    0.7194251585E-04
 mylbfgs> Energy and RMS force=    -273.6087326        0.2371842884E-04 after      5 steps, step:  0.19650E-02
 mylbfgs> true and projected RMS:     0.2371844397E-04    0.2371842884E-04
 mylbfgs> Energy and RMS force=    -273.6087327        0.1612888236E-04 after      6 steps, step:  0.74794E-03
 mylbfgs> true and projected RMS:     0.1612889263E-04    0.1612888236E-04
 mylbfgs> Energy and RMS force=    -273.6087327        0.2430428962E-04 after      7 steps, step:  0.13364E-02
 mylbfgs> true and projected RMS:     0.2430429048E-04    0.2430428962E-04
 mylbfgs> Energy and RMS force=    -273.6087328        0.3426589394E-04 after      8 steps, step:  0.26326E-02
 mylbfgs> true and projected RMS:     0.3426589432E-04    0.3426589394E-04
 mylbfgs> Energy and RMS force=    -273.6087330        0.4545149239E-04 after      9 steps, step:  0.71527E-02
 mylbfgs> true and projected RMS:     0.4545149872E-04    0.4545149239E-04
 mylbfgs> Energy and RMS force=    -273.6087331        0.1409687228E-03 after     10 steps, step:  0.18620E-01
 mylbfgs> true and projected RMS:     0.1409687557E-03    0.1409687228E-03
 bfgsts> RMS grad=    0.1409687557E-03 subspace grad=    0.1409687228E-03 unscaled EF step length=    0.4668069029E-04

 BFGSTS> Beginning of optimization cycle   10.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.27969E-02   -0.24856E-02   -0.31083E-02  -273.608733134      -273.608733135      -273.608733133     0.100E-02
predicted gradient component=    0.5834976946E-06
xmylbfgs> Eigenvalue and RMS=   -0.2485552088E-02    0.1002329641E-02 after      0 steps
 xmylbfgs> Turning off convergence after 0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.26680E-02   -0.24833E-02   -0.28527E-02  -273.608733134      -273.608733135      -273.608733133     0.100E-02
predicted gradient component=    0.6390052931E-06
xmylbfgs> Eigenvalue, RMS, % change=  -0.2483265700E-02   0.9995087346E-03   0.9207181232E-01 after      1 steps, step: 0.0000045210
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.26530E-02   -0.24833E-02   -0.28227E-02  -273.608733134      -273.608733134      -273.608733133     0.120E-02
predicted gradient component=   -0.1635100944E-06
xmylbfgs> Eigenvalue, RMS, % change=  -0.2483302798E-02   0.1199882898E-02   0.1493886266E-02 after      2 steps, step: 0.0028281665
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.26739E-02   -0.24885E-02   -0.28593E-02  -273.608733134      -273.608733134      -273.608733133     0.187E-03
predicted gradient component=    0.2069953098E-06
xmylbfgs> Eigenvalue, RMS, % change=  -0.2488548856E-02   0.1867860058E-03   0.2108079190     after      3 steps, step: 0.0013340403
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.26760E-02   -0.24887E-02   -0.28632E-02  -273.608733134      -273.608733135      -273.608733133     0.134E-03
predicted gradient component=    0.2320064141E-06
xmylbfgs> Eigenvalue, RMS, % change=  -0.2488748434E-02   0.1335040480E-03   0.8019191580E-02 after      4 steps, step: 0.0001857255
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.26739E-02   -0.24892E-02   -0.28587E-02  -273.608733134      -273.608733135      -273.608733133     0.114E-03
predicted gradient component=    0.2769979801E-06
xmylbfgs> Eigenvalue, RMS, % change=  -0.2489170133E-02   0.1144672600E-03   0.1694136824E-01 after      5 steps, step: 0.0007361444
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.26739E-02   -0.24894E-02   -0.28585E-02  -273.608733134      -273.608733134      -273.608733133     0.105E-03
predicted gradient component=    0.1730029453E-06
xmylbfgs> Eigenvalue, RMS, % change=  -0.2489377516E-02   0.1052462810E-03   0.8330726008E-02 after      6 steps, step: 0.0005084428
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.26630E-02   -0.24895E-02   -0.28365E-02  -273.608733134      -273.608733134      -273.608733133     0.215E-03
predicted gradient component=    0.4749267646E-07
xmylbfgs> Eigenvalue, RMS, % change=  -0.2489510638E-02   0.2154066179E-03   0.5347299024E-02 after      7 steps, step: 0.0013813342
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.26419E-02   -0.24895E-02   -0.27942E-02  -273.608733134      -273.608733134      -273.608733133     0.932E-04
predicted gradient component=    0.3799982551E-07
xmylbfgs> Eigenvalue, RMS, % change=  -0.2489525211E-02   0.9321793310E-04   0.5853662032E-03 after      8 steps, step: 0.0003650112
 xmylbfgs> Smallest eigenvalue converged in    8 steps. Eigenvalue=     -0.0024895 RMS force=      0.0000932 % change=    0.58537E-03
 xmylbfgs> Diagonal inverse Hessian elements are now         0.3341569733
beig> Overlap with previous vector=      0.9999935
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1    0.553879E-08   -0.248953E-02  0.222484E-05  0.272727E-01    0.449066E+00
 -------------------------------------------------------------------------------
 mylbfgs> Not resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6087331        0.1409682347E-03 after      0 steps
 mylbfgs> true and projected RMS:     0.1409682347E-03    0.1409682347E-03
 mylbfgs> Energy and RMS force=    -273.6087335        0.6073443667E-04 after      1 steps, step:  0.34381E-02
 mylbfgs> true and projected RMS:     0.6073443702E-04    0.6073443667E-04
 mylbfgs> Energy and RMS force=    -273.6087339        0.4597431806E-04 after      2 steps, step:  0.11524E-01
 mylbfgs> true and projected RMS:     0.4597433389E-04    0.4597431806E-04
 mylbfgs> Energy and RMS force=    -273.6087342        0.1002765847E-03 after      3 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1002766678E-03    0.1002765847E-03
 mylbfgs> Energy and RMS force=    -273.6087343        0.1089439614E-03 after      4 steps, step:  0.13512E-01
 mylbfgs> true and projected RMS:     0.1089439905E-03    0.1089439614E-03
 mylbfgs> Energy and RMS force=    -273.6087345        0.6752017378E-04 after      5 steps, step:  0.26673E-02
 mylbfgs> true and projected RMS:     0.6752021207E-04    0.6752017378E-04
 mylbfgs> Energy and RMS force=    -273.6087347        0.7218456838E-04 after      6 steps, step:  0.10801E-01
 mylbfgs> true and projected RMS:     0.7218478623E-04    0.7218456838E-04
 mylbfgs> Energy and RMS force=    -273.6087349        0.6222409040E-04 after      7 steps, step:  0.45572E-02
 mylbfgs> true and projected RMS:     0.6222427438E-04    0.6222409040E-04
 mylbfgs> Energy and RMS force=    -273.6087351        0.7512602363E-04 after      8 steps, step:  0.12341E-01
 mylbfgs> true and projected RMS:     0.7512622729E-04    0.7512602363E-04
 mylbfgs> Energy and RMS force=    -273.6087354        0.1426984463E-03 after      9 steps, step:  0.20000E-01
 mylbfgs> true and projected RMS:     0.1426987017E-03    0.1426984463E-03
 mylbfgs> Energy and RMS force=    -273.6087358        0.1042453945E-03 after     10 steps, step:  0.37171E-02
 mylbfgs> true and projected RMS:     0.1042454951E-03    0.1042453945E-03
 bfgsts> RMS grad=    0.1042454951E-03 subspace grad=    0.1042453945E-03 unscaled EF step length=    0.2224838517E-05

 BFGSTS> Beginning of optimization cycle   11.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.29360E-02   -0.26487E-02   -0.32233E-02  -273.608735790      -273.608735791      -273.608735789     0.189E-02
predicted gradient component=    0.9239897736E-06
xmylbfgs> Eigenvalue and RMS=   -0.2648672042E-02    0.1892720908E-02 after      0 steps
 xmylbfgs> Turning off convergence after 0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.28140E-02   -0.26461E-02   -0.29818E-02  -273.608735789      -273.608735791      -273.608735789     0.188E-02
predicted gradient component=    0.9549978586E-06
xmylbfgs> Eigenvalue, RMS, % change=  -0.2646145932E-02   0.1880319023E-02   0.9546374064E-01 after      1 steps, step: 0.0000161208
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.28830E-02   -0.26620E-02   -0.31039E-02  -273.608735789      -273.608735792      -273.608735789     0.729E-03
predicted gradient component=    0.1469516064E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2662040757E-02   0.7287223023E-03   0.5970917069     after      2 steps, step: 0.0029617853
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.28710E-02   -0.26640E-02   -0.30781E-02  -273.608735789      -273.608735792      -273.608735789     0.303E-03
predicted gradient component=    0.1530480631E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2664024570E-02   0.3028149695E-03   0.7446675606E-01 after      3 steps, step: 0.0008288851
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.28899E-02   -0.26647E-02   -0.31151E-02  -273.608735789      -273.608735792      -273.608735789     0.246E-03
predicted gradient component=    0.1566007768E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2664718800E-02   0.2464947335E-03   0.2605266414E-01 after      4 steps, step: 0.0003617825
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.28920E-02   -0.26663E-02   -0.31176E-02  -273.608735789      -273.608735792      -273.608735789     0.233E-03
predicted gradient component=    0.1740005473E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2666325339E-02   0.2332905533E-03   0.6025291057E-01 after      5 steps, step: 0.0018146705
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.28930E-02   -0.26673E-02   -0.31187E-02  -273.608735789      -273.608735792      -273.608735789     0.381E-03
predicted gradient component=    0.1816488293E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2667318721E-02   0.3812661681E-03   0.3724273308E-01 after      6 steps, step: 0.0019834920
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.28340E-02   -0.26683E-02   -0.29996E-02  -273.608735789      -273.608735792      -273.608735789     0.203E-03
predicted gradient component=    0.1791988780E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2668338194E-02   0.2033429275E-03   0.3820629647E-01 after      7 steps, step: 0.0012286969
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.27831E-02   -0.26687E-02   -0.28974E-02  -273.608735789      -273.608735792      -273.608735789     0.153E-03
predicted gradient component=    0.1719484999E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2668739406E-02   0.1526746247E-03   0.1503377162E-01 after      8 steps, step: 0.0013230888
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.28029E-02   -0.26691E-02   -0.29368E-02  -273.608735789      -273.608735792      -273.608735789     0.193E-03
predicted gradient component=    0.1662499471E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2669114445E-02   0.1933619679E-03   0.1405106559E-01 after      9 steps, step: 0.0011385354
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.28999E-02   -0.26696E-02   -0.31302E-02  -273.608735789      -273.608735792      -273.608735789     0.151E-03
predicted gradient component=    0.1518998261E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2669631446E-02   0.1512970593E-03   0.1936600881E-01 after     10 steps, step: 0.0014620570
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.29149E-02   -0.26698E-02   -0.31600E-02  -273.608735789      -273.608735792      -273.608735789     0.984E-04
predicted gradient component=    0.1475513045E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2669847771E-02   0.9842933616E-04   0.8102521776E-02 after     11 steps, step: 0.0008616008
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.28140E-02   -0.26702E-02   -0.29578E-02  -273.608735789      -273.608735792      -273.608735789     0.102E-03
predicted gradient component=    0.1425007667E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2670185753E-02   0.1018308182E-03   0.1265760850E-01 after     12 steps, step: 0.0009545116
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.29349E-02   -0.26703E-02   -0.31996E-02  -273.608735789      -273.608735792      -273.608735789     0.119E-03
predicted gradient component=    0.1432482577E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2670285709E-02   0.1185349785E-03   0.3743279670E-02 after     13 steps, step: 0.0007957922
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.28990E-02   -0.26704E-02   -0.31276E-02  -273.608735789      -273.608735792      -273.608735789     0.772E-04
predicted gradient component=    0.1376491809E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2670388174E-02   0.7717967029E-04   0.3837059820E-02 after     14 steps, step: 0.0003865755
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.27981E-02   -0.26706E-02   -0.29255E-02  -273.608735789      -273.608735792      -273.608735789     0.853E-04
predicted gradient component=    0.1304982788E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2670582910E-02   0.8525300508E-04   0.7291900366E-02 after     15 steps, step: 0.0007754432
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.28240E-02   -0.26706E-02   -0.29774E-02  -273.608735789      -273.608735792      -273.608735789     0.111E-03
predicted gradient component=    0.1239016001E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2670590440E-02   0.1105230361E-03   0.2819592884E-03 after     16 steps, step: 0.0007845960
 xmylbfgs> Smallest eigenvalue converged in   16 steps. Eigenvalue=     -0.0026706 RMS force=      0.0001105 % change=    0.28196E-03
 xmylbfgs> Diagonal inverse Hessian elements are now         0.3595017394
beig> Overlap with previous vector=      0.9999276
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1    0.129216E-05   -0.267059E-02  0.483847E-03  0.300000E-01    0.158338E-02
 -------------------------------------------------------------------------------
 mylbfgs> Not resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6087358        0.1042383584E-03 after      0 steps
 mylbfgs> true and projected RMS:     0.1042383584E-03    0.1042383584E-03
 mylbfgs> Energy and RMS force=    -273.6087361        0.8974886638E-04 after      1 steps, step:  0.12958E-01
 mylbfgs> true and projected RMS:     0.8974888009E-04    0.8974886638E-04
 mylbfgs> Energy and RMS force=    -273.6087363        0.6168255835E-04 after      2 steps, step:  0.37420E-02
 mylbfgs> true and projected RMS:     0.6168257251E-04    0.6168255835E-04
 mylbfgs> Energy and RMS force=    -273.6087364        0.5059070648E-04 after      3 steps, step:  0.53263E-02
 mylbfgs> true and projected RMS:     0.5059075062E-04    0.5059070648E-04
 mylbfgs> Energy and RMS force=    -273.6087365        0.8439295584E-04 after      4 steps, step:  0.95774E-02
 mylbfgs> true and projected RMS:     0.8439305497E-04    0.8439295584E-04
 mylbfgs> Energy and RMS force=    -273.6087367        0.1184754764E-03 after      5 steps, step:  0.65581E-02
 mylbfgs> true and projected RMS:     0.1184755975E-03    0.1184754764E-03
 mylbfgs> Energy and RMS force=    -273.6087370        0.1103562956E-03 after      6 steps, step:  0.15036E-01
 mylbfgs> true and projected RMS:     0.1103567018E-03    0.1103562956E-03
 mylbfgs> Energy and RMS force=    -273.6087371        0.3696184217E-04 after      7 steps, step:  0.21267E-02
 mylbfgs> true and projected RMS:     0.3696269827E-04    0.3696184217E-04
 mylbfgs> Energy and RMS force=    -273.6087372        0.2492937942E-04 after      8 steps, step:  0.88448E-02
 mylbfgs> true and projected RMS:     0.2493131757E-04    0.2492937942E-04
 mylbfgs> Energy and RMS force=    -273.6087372        0.4873019953E-04 after      9 steps, step:  0.12159E-02
 mylbfgs> true and projected RMS:     0.4873107709E-04    0.4873019953E-04
 mylbfgs> Energy and RMS force=    -273.6087372        0.1110997990E-04 after     10 steps, step:  0.79856E-03
 mylbfgs> true and projected RMS:     0.1111386771E-04    0.1110997990E-04
 bfgsts> RMS grad=    0.1111386771E-04 subspace grad=    0.1110997990E-04 unscaled EF step length=    0.4838469838E-03

 BFGSTS> Beginning of optimization cycle   12.
 ---------------------------------------
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.26490E-02   -0.26230E-02   -0.26750E-02  -273.608737210      -273.608737214      -273.608737211     0.947E-03
predicted gradient component=    0.1962519036E-05
xmylbfgs> Eigenvalue and RMS=   -0.2622997375E-02    0.9472285113E-03 after      0 steps
 xmylbfgs> Turning off convergence after 0 steps
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.26300E-02   -0.26202E-02   -0.26399E-02  -273.608737211      -273.608737214      -273.608737211     0.944E-03
predicted gradient component=    0.1931994120E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2620175169E-02   0.9444786447E-03   0.1077105930     after      1 steps, step: 0.0000040376
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.26951E-02   -0.26198E-02   -0.27703E-02  -273.608737210      -273.608737214      -273.608737211     0.119E-02
predicted gradient component=    0.1985512199E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2619801634E-02   0.1189948639E-02   0.1425813123E-01 after      2 steps, step: 0.0024625246
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.27251E-02   -0.26245E-02   -0.28256E-02  -273.608737211      -273.608737214      -273.608737211     0.174E-03
predicted gradient component=    0.1979486797E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2624529170E-02   0.1736187690E-03   0.1801289193     after      3 steps, step: 0.0011870682
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.26770E-02   -0.26247E-02   -0.27292E-02  -273.608737211      -273.608737214      -273.608737211     0.133E-03
predicted gradient component=    0.1966498075E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2624729102E-02   0.1326818468E-03   0.7617238263E-02 after      4 steps, step: 0.0001798511
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.26810E-02   -0.26252E-02   -0.27367E-02  -273.608737211      -273.608737214      -273.608737211     0.104E-03
predicted gradient component=    0.1969482355E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2625182305E-02   0.1040336459E-03   0.1726370417E-01 after      5 steps, step: 0.0008027248
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.26880E-02   -0.26253E-02   -0.27507E-02  -273.608737211      -273.608737214      -273.608737211     0.105E-03
predicted gradient component=    0.1924007620E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2625293122E-02   0.1052294839E-03   0.4221121169E-02 after      6 steps, step: 0.0005111844
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.27470E-02   -0.26254E-02   -0.28686E-02  -273.608737211      -273.608737214      -273.608737211     0.174E-03
predicted gradient component=    0.1934495231E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2625393357E-02   0.1737518943E-03   0.3817877591E-02 after      7 steps, step: 0.0015334277
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.26280E-02   -0.26256E-02   -0.26304E-02  -273.608737210      -273.608737214      -273.608737211     0.936E-04
predicted gradient component=    0.1946006023E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2625573128E-02   0.9360613426E-04   0.6846940117E-02 after      8 steps, step: 0.0003051959
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.26951E-02   -0.26256E-02   -0.27645E-02  -273.608737211      -273.608737214      -273.608737211     0.558E-04
predicted gradient component=    0.1943504913E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2625638709E-02   0.5581844872E-04   0.2497734116E-02 after      9 steps, step: 0.0001601170
 secdiag> D,D2,D3,E+,E-,E,RMS=   -0.27230E-02   -0.26256E-02   -0.28204E-02  -273.608737211      -273.608737214      -273.608737211     0.408E-04
predicted gradient component=    0.1927503490E-05
xmylbfgs> Eigenvalue, RMS, % change=  -0.2625635857E-02   0.4084992982E-04   0.1086416267E-03 after     10 steps, step: 0.0002136388
 xmylbfgs> Smallest eigenvalue converged in   10 steps. Eigenvalue=     -0.0026256 RMS force=      0.0000408 % change=    0.10864E-03
 xmylbfgs> Diagonal inverse Hessian elements are now         0.2292391634
beig> Overlap with previous vector=      0.9999942
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1    0.197453E-05   -0.262564E-02  0.752021E-03  0.300000E-01    0.150436E-02
 -------------------------------------------------------------------------------
 mylbfgs> Not resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6087372        0.1110513550E-04 after      0 steps
 mylbfgs> true and projected RMS:     0.1110513551E-04    0.1110513550E-04
 mylbfgs> Energy and RMS force=    -273.6087372        0.8434602313E-05 after      1 steps, step:  0.61286E-03
 mylbfgs> true and projected RMS:     0.8434602382E-05    0.8434602313E-05
 mylbfgs> Diagonal inverse Hessian elements are now         0.3180327384
 mylbfgs> Final energy is   -273.60873721328397    
 bfgsts> RMS grad=    0.8434602382E-05 subspace grad=    0.8434602313E-05 unscaled EF step length=    0.7520208867E-03
 Converged to TS (number of iterations):         12
 DNEB run yielded 1 true transition state(s) time=      1.29
 Energies:
  -273.60873721328397     

 >>>>>  Path run for ts 3 ...
 bfgsts> resetting maximum uphill step size to     0.2000000000E-01

 bfgsts> Stepping away from saddle along softest mode + direction
 -------------------------------------------------------------------------------
 Vector      Gradient        Secder       Step          Max step     Trust ratio
 -------------------------------------------------------------------------------
    1    0.000000E+00   -0.262564E-02  0.100000E+00  0.181818E-01    0.100000E+01
 -------------------------------------------------------------------------------
 golden> golden a, b, c, d=     0.000000000        0.1000000000        0.3819660113E-01    0.6180339887E-01 initially
 golden> energy at ts, C and D and diff=    -273.608737213284        -273.608738993802        -273.608741546860       -0.433357604379125E-05
 golden> energy at ts, C and D and diff=    -273.608737213284        -273.608741546805        -273.608743463036       -0.624975200480549E-05
 golden> energy at ts, C and D and diff=    -273.608737213284        -273.608743463012        -273.608744709523       -0.749623904994223E-05
 golden> energy at ts, C and D and diff=    -273.608737213284        -273.608744709695        -273.608745485544       -0.827226000410519E-05
 golden> energy at ts, C and D and diff=    -273.608737213284        -273.608745485596        -273.608745962651       -0.874936705486107E-05
 golden> energy at ts, C and D and diff=    -273.608737213284        -273.608745962692        -273.608746255455       -0.904217102970506E-05
 golden> energy at ts, C and D and diff=    -273.608737213284        -273.608746255542        -273.608746435288       -0.922200405284457E-05
 golden> energy at ts, C and D and diff=    -273.608737213284        -273.608746435309        -273.608746545851       -0.933256700363927E-05
 golden> energy at ts, C and D and diff=    -273.608737213284        -273.608746545827        -273.608746614069       -0.940078501798780E-05
 golden> energy at ts, C and D and diff=    -273.608737213284        -273.608746614214        -273.608746656240       -0.944295601357226E-05
 path> golden section + pushoff, energy, delta, step:     -273.608746656240       -0.944295601357226E-05    0.995934690628392E-01
 mylbfgs> Resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6087467        0.3578509668E-03 after      0 steps
 mylbfgs> Energy and RMS force=    -273.6087467        0.3577993438E-03 after      1 steps, step:  0.57626E-06
 energy increase:    -273.608746670816     to     -273.608706607929     decreasing step to  0.78896783E-03
 mylbfgs> Energy and RMS force=    -273.6087480        0.1458915348E-03 after      2 steps, step:  0.78897E-03
 mylbfgs> Energy and RMS force=    -273.6087483        0.6704560330E-04 after      3 steps, step:  0.61426E-03
 mylbfgs> Energy and RMS force=    -273.6087484        0.6459469978E-04 after      4 steps, step:  0.33398E-03
 mylbfgs> Energy and RMS force=    -273.6087486        0.6863640518E-04 after      5 steps, step:  0.10903E-02
 mylbfgs> Energy and RMS force=    -273.6087487        0.1429800701E-03 after      6 steps, step:  0.12738E-02
 mylbfgs> Energy and RMS force=    -273.6087489        0.6460688867E-04 after      7 steps, step:  0.31989E-03
 mylbfgs> Energy and RMS force=    -273.6087490        0.5926417539E-04 after      8 steps, step:  0.50686E-03
 mylbfgs> Energy and RMS force=    -273.6087491        0.8185033870E-04 after      9 steps, step:  0.77714E-03
 mylbfgs> Energy and RMS force=    -273.6087493        0.1087781908E-03 after     10 steps, step:  0.18341E-02
 mylbfgs> Energy and RMS force=    -273.6087497        0.1528353300E-03 after     11 steps, step:  0.39787E-02
 mylbfgs> Energy and RMS force=    -273.6087500        0.2190745278E-03 after     12 steps, step:  0.75463E-02
 mylbfgs> Energy and RMS force=    -273.6087505        0.1068925302E-03 after     13 steps, step:  0.69837E-03
 mylbfgs> Energy and RMS force=    -273.6087509        0.1085770355E-03 after     14 steps, step:  0.17123E-02
 mylbfgs> Energy and RMS force=    -273.6087513        0.1419826876E-03 after     15 steps, step:  0.27051E-02
 mylbfgs> Energy and RMS force=    -273.6087525        0.2275587016E-03 after     16 steps, step:  0.10550E-01
 mylbfgs> Energy and RMS force=    -273.6087539        0.4105031839E-03 after     17 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087563        0.2910870903E-03 after     18 steps, step:  0.19077E-01
 mylbfgs> Energy and RMS force=    -273.6087588        0.2360977901E-03 after     19 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087613        0.2416813478E-03 after     20 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087637        0.2898143446E-03 after     21 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087660        0.3402873568E-03 after     22 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087686        0.3526170194E-03 after     23 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087717        0.3950524321E-03 after     24 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087751        0.3894311397E-03 after     25 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087793        0.3975134784E-03 after     26 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087841        0.4022557719E-03 after     27 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087894        0.4233568838E-03 after     28 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087959        0.4093856800E-03 after     29 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6088027        0.4144381075E-03 after     30 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6088105        0.4018360531E-03 after     31 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6088176        0.3774793874E-03 after     32 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6088268        0.3326027359E-03 after     33 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6088311        0.3452147070E-03 after     34 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6088391        0.2888208688E-03 after     35 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6088407        0.2819972247E-03 after     36 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6088435        0.1666727657E-03 after     37 steps, step:  0.44404E-02
 mylbfgs> Energy and RMS force=    -273.6088458        0.1035571021E-03 after     38 steps, step:  0.49868E-02
 mylbfgs> Energy and RMS force=    -273.6088466        0.1463090815E-03 after     39 steps, step:  0.53517E-02
 mylbfgs> Energy and RMS force=    -273.6088471        0.7118589388E-04 after     40 steps, step:  0.29691E-02
 mylbfgs> Energy and RMS force=    -273.6088473        0.4053996860E-04 after     41 steps, step:  0.24977E-02
 mylbfgs> Energy and RMS force=    -273.6088474        0.3564831903E-04 after     42 steps, step:  0.17025E-02
 mylbfgs> Energy and RMS force=    -273.6088476        0.4097508699E-04 after     43 steps, step:  0.17037E-02
 mylbfgs> Energy and RMS force=    -273.6088477        0.3129013582E-04 after     44 steps, step:  0.19641E-02
 mylbfgs> Energy and RMS force=    -273.6088478        0.2337724384E-04 after     45 steps, step:  0.12450E-02
 mylbfgs> Energy and RMS force=    -273.6088478        0.2266336461E-04 after     46 steps, step:  0.20050E-02
 mylbfgs> Energy and RMS force=    -273.6088479        0.4011765366E-04 after     47 steps, step:  0.22323E-02
 mylbfgs> Energy and RMS force=    -273.6088479        0.2328149268E-04 after     48 steps, step:  0.12600E-02
 mylbfgs> Energy and RMS force=    -273.6088480        0.1350793885E-04 after     49 steps, step:  0.13683E-02
 mylbfgs> Energy and RMS force=    -273.6088480        0.1157821570E-04 after     50 steps, step:  0.59127E-03
 mylbfgs> Energy and RMS force=    -273.6088480        0.9829587198E-05 after     51 steps, step:  0.90983E-03
 mylbfgs> Diagonal inverse Hessian elements are now         4.7845690962
 mylbfgs> Final energy is   -273.60884801836897    
 Plus  side of path:                      52 steps. Energy=    -273.6088480       time=       0.19
 golden> golden a, b, c, d=     0.000000000       -0.1000000000       -0.3819660113E-01   -0.6180339887E-01 initially
 golden> energy at ts, C and D and diff=    -273.608737213284        -273.608739181996        -273.608742334309       -0.512102502625567E-05
 golden> energy at ts, C and D and diff=    -273.608737213284        -273.608742334301        -273.608744935727       -0.772244300151215E-05
 golden> energy at ts, C and D and diff=    -273.608737213284        -273.608744935566        -273.608746753602       -0.954031804667466E-05
 golden> energy at ts, C and D and diff=    -273.608737213284        -273.608746753468        -273.608747945092       -0.107318080040386E-04
 golden> energy at ts, C and D and diff=    -273.608737213284        -273.608747945023        -273.608748704010       -0.114907260240216E-04
 golden> energy at ts, C and D and diff=    -273.608737213284        -273.608748703993        -273.608749180889       -0.119676050189810E-04
 golden> energy at ts, C and D and diff=    -273.608737213284        -273.608749180975        -273.608749478484       -0.122652000413837E-04
 golden> energy at ts, C and D and diff=    -273.608737213284        -273.608749478507        -273.608749663560       -0.124502760172618E-04
 golden> energy at ts, C and D and diff=    -273.608737213284        -273.608749663534        -273.608749778122       -0.125648380162602E-04
 golden> energy at ts, C and D and diff=    -273.608737213284        -273.608749778258        -273.608749849231       -0.126359470300486E-04
 path> golden section - pushoff, energy, delta, step:     -273.608749849231       -0.126359470300486E-04   -0.995934690628392E-01
 mylbfgs> Resetting LBFGS minimiser
 mylbfgs> Energy and RMS force=    -273.6087499        0.3582791347E-03 after      0 steps
 mylbfgs> Energy and RMS force=    -273.6087499        0.3580283287E-03 after      1 steps, step:  0.57764E-06
 mylbfgs> Energy and RMS force=    -273.6087513        0.1479288503E-03 after      2 steps, step:  0.15536E-02
 mylbfgs> Energy and RMS force=    -273.6087516        0.7509193411E-04 after      3 steps, step:  0.38906E-03
 mylbfgs> Energy and RMS force=    -273.6087517        0.6958049243E-04 after      4 steps, step:  0.40453E-03
 mylbfgs> Energy and RMS force=    -273.6087519        0.9392533123E-04 after      5 steps, step:  0.64212E-03
 mylbfgs> Energy and RMS force=    -273.6087521        0.1202134206E-03 after      6 steps, step:  0.13211E-02
 mylbfgs> Energy and RMS force=    -273.6087523        0.1091134087E-03 after      7 steps, step:  0.14461E-02
 mylbfgs> Energy and RMS force=    -273.6087526        0.9900591897E-04 after      8 steps, step:  0.14322E-02
 mylbfgs> Energy and RMS force=    -273.6087531        0.1323049215E-03 after      9 steps, step:  0.27697E-02
 mylbfgs> Energy and RMS force=    -273.6087538        0.1802724578E-03 after     10 steps, step:  0.40082E-02
 mylbfgs> Energy and RMS force=    -273.6087554        0.2503800033E-03 after     11 steps, step:  0.99366E-02
 mylbfgs> Energy and RMS force=    -273.6087587        0.3655486183E-03 after     12 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087624        0.3972505958E-03 after     13 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087665        0.4428643732E-03 after     14 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6087710        0.4891070947E-03 after     15 steps, step:  0.20000E-01
 mylbfgs> Resetting LBFGS routine - step scaling factor was     0.3970408641E-01
 mylbfgs> Energy and RMS force=    -273.6087710        0.4889617798E-03 after     16 steps, step:  0.10765E-05
 mylbfgs> Energy and RMS force=    -273.6087829        0.3945079883E-03 after     17 steps, step:  0.61710E-02
 mylbfgs> Energy and RMS force=    -273.6087887        0.4472890805E-03 after     18 steps, step:  0.50171E-02
 mylbfgs> Energy and RMS force=    -273.6087928        0.5441187770E-03 after     19 steps, step:  0.84668E-02
 mylbfgs> Energy and RMS force=    -273.6087964        0.2604350801E-03 after     20 steps, step:  0.18130E-02
 mylbfgs> Energy and RMS force=    -273.6087984        0.2433332846E-03 after     21 steps, step:  0.20232E-02
 mylbfgs> Energy and RMS force=    -273.6088005        0.2368665575E-03 after     22 steps, step:  0.38595E-02
 mylbfgs> Energy and RMS force=    -273.6088010        0.5320025097E-03 after     23 steps, step:  0.59776E-02
 mylbfgs> Energy and RMS force=    -273.6088030        0.1973957559E-03 after     24 steps, step:  0.92067E-03
 mylbfgs> Energy and RMS force=    -273.6088040        0.1595258696E-03 after     25 steps, step:  0.13982E-02
 mylbfgs> Energy and RMS force=    -273.6088061        0.2650858855E-03 after     26 steps, step:  0.45730E-02
 mylbfgs> Energy and RMS force=    -273.6088092        0.3709978711E-03 after     27 steps, step:  0.79763E-02
 mylbfgs> Energy and RMS force=    -273.6088149        0.7080780935E-03 after     28 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6088226        0.5872273843E-03 after     29 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6088316        0.5309263953E-03 after     30 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6088417        0.5086955194E-03 after     31 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6088525        0.5169483540E-03 after     32 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6088633        0.5417111665E-03 after     33 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6088748        0.5598223495E-03 after     34 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6088868        0.6083686126E-03 after     35 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6088985        0.6283003369E-03 after     36 steps, step:  0.20000E-01
 mylbfgs> Resetting LBFGS routine - step scaling factor was     0.8493666619E-01
 mylbfgs> Energy and RMS force=    -273.6088985        0.6279338526E-03 after     37 steps, step:  0.17764E-05
 mylbfgs> Energy and RMS force=    -273.6089117        0.6091559791E-03 after     38 steps, step:  0.49902E-02
 mylbfgs> Energy and RMS force=    -273.6089213        0.7677362767E-03 after     39 steps, step:  0.51478E-02
 mylbfgs> Energy and RMS force=    -273.6089415        0.7134108734E-03 after     40 steps, step:  0.14179E-01
 energy increase:    -273.608941450464     to     -273.608914342324     decreasing step to  0.20000000E-02
 mylbfgs> Energy and RMS force=    -273.6089444        0.6152570617E-03 after     41 steps, step:  0.20000E-02
 mylbfgs> Energy and RMS force=    -273.6089540        0.3890022230E-03 after     42 steps, step:  0.10352E-01
 mylbfgs> Energy and RMS force=    -273.6089589        0.4365379825E-03 after     43 steps, step:  0.55424E-02
 mylbfgs> Energy and RMS force=    -273.6089652        0.5425216787E-03 after     44 steps, step:  0.99971E-02
 mylbfgs> Energy and RMS force=    -273.6089695        0.4068299970E-03 after     45 steps, step:  0.57045E-02
 mylbfgs> Energy and RMS force=    -273.6089730        0.3306930323E-03 after     46 steps, step:  0.37661E-02
 mylbfgs> Energy and RMS force=    -273.6089785        0.5184591303E-03 after     47 steps, step:  0.80762E-02
 mylbfgs> Energy and RMS force=    -273.6089842        0.6262074316E-03 after     48 steps, step:  0.96726E-02
 mylbfgs> Energy and RMS force=    -273.6089930        0.7897070671E-03 after     49 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6090018        0.4679781704E-03 after     50 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6090082        0.3578462784E-03 after     51 steps, step:  0.88206E-02
 mylbfgs> Energy and RMS force=    -273.6090164        0.5635990811E-03 after     52 steps, step:  0.12892E-01
 mylbfgs> Energy and RMS force=    -273.6090238        0.6102314602E-03 after     53 steps, step:  0.13310E-01
 mylbfgs> Energy and RMS force=    -273.6090337        0.6490699072E-03 after     54 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6090437        0.5268666050E-03 after     55 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6090532        0.4457672992E-03 after     56 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6090621        0.3914164753E-03 after     57 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6090701        0.4150041265E-03 after     58 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6090775        0.4562786718E-03 after     59 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6090848        0.4246883957E-03 after     60 steps, step:  0.13915E-01
 mylbfgs> Energy and RMS force=    -273.6090940        0.4350891726E-03 after     61 steps, step:  0.13371E-01
 mylbfgs> Energy and RMS force=    -273.6091035        0.4059531133E-03 after     62 steps, step:  0.12013E-01
 mylbfgs> Energy and RMS force=    -273.6091127        0.4208800157E-03 after     63 steps, step:  0.11021E-01
 mylbfgs> Energy and RMS force=    -273.6091195        0.4027003921E-03 after     64 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091220        0.3079421264E-03 after     65 steps, step:  0.17411E-01
 mylbfgs> Energy and RMS force=    -273.6091236        0.1026378905E-03 after     66 steps, step:  0.32600E-02
 mylbfgs> Energy and RMS force=    -273.6091240        0.9370195322E-04 after     67 steps, step:  0.25725E-02
 mylbfgs> Energy and RMS force=    -273.6091251        0.1229366233E-03 after     68 steps, step:  0.38671E-02
 mylbfgs> Energy and RMS force=    -273.6091260        0.1573462164E-03 after     69 steps, step:  0.55198E-02
 mylbfgs> Energy and RMS force=    -273.6091266        0.1069274223E-03 after     70 steps, step:  0.41671E-02
 mylbfgs> Energy and RMS force=    -273.6091270        0.7488592638E-04 after     71 steps, step:  0.40535E-02
 mylbfgs> Energy and RMS force=    -273.6091274        0.8449341007E-04 after     72 steps, step:  0.33578E-02
 mylbfgs> Energy and RMS force=    -273.6091281        0.1307475940E-03 after     73 steps, step:  0.37830E-02
 mylbfgs> Energy and RMS force=    -273.6091295        0.1315997402E-03 after     74 steps, step:  0.91289E-02
 mylbfgs> Energy and RMS force=    -273.6091311        0.2317466308E-03 after     75 steps, step:  0.16722E-01
 mylbfgs> Energy and RMS force=    -273.6091325        0.1137698745E-03 after     76 steps, step:  0.95318E-02
 mylbfgs> Energy and RMS force=    -273.6091335        0.9717563593E-04 after     77 steps, step:  0.95374E-02
 mylbfgs> Energy and RMS force=    -273.6091342        0.1110921709E-03 after     78 steps, step:  0.56078E-02
 mylbfgs> Energy and RMS force=    -273.6091355        0.1029515027E-03 after     79 steps, step:  0.10639E-01
 mylbfgs> Energy and RMS force=    -273.6091369        0.1574470157E-03 after     80 steps, step:  0.14662E-01
 mylbfgs> Energy and RMS force=    -273.6091385        0.9956514821E-04 after     81 steps, step:  0.16287E-01
 mylbfgs> Energy and RMS force=    -273.6091400        0.1082940384E-03 after     82 steps, step:  0.11814E-01
 mylbfgs> Energy and RMS force=    -273.6091412        0.8596571416E-04 after     83 steps, step:  0.12995E-01
 mylbfgs> Energy and RMS force=    -273.6091416        0.7748777580E-04 after     84 steps, step:  0.54871E-02
 mylbfgs> Energy and RMS force=    -273.6091418        0.4732578792E-04 after     85 steps, step:  0.30035E-02
 mylbfgs> Energy and RMS force=    -273.6091420        0.5365703124E-04 after     86 steps, step:  0.22160E-02
 mylbfgs> Energy and RMS force=    -273.6091422        0.5255241746E-04 after     87 steps, step:  0.22349E-02
 mylbfgs> Energy and RMS force=    -273.6091425        0.5024134091E-04 after     88 steps, step:  0.39516E-02
 mylbfgs> Energy and RMS force=    -273.6091427        0.5735077061E-04 after     89 steps, step:  0.68144E-02
 mylbfgs> Energy and RMS force=    -273.6091429        0.3927798748E-04 after     90 steps, step:  0.22879E-02
 mylbfgs> Energy and RMS force=    -273.6091429        0.4922042367E-04 after     91 steps, step:  0.18552E-02
 mylbfgs> Energy and RMS force=    -273.6091430        0.2813197210E-04 after     92 steps, step:  0.22286E-02
 mylbfgs> Energy and RMS force=    -273.6091431        0.2733322290E-04 after     93 steps, step:  0.11996E-02
 mylbfgs> Energy and RMS force=    -273.6091431        0.4343538399E-04 after     94 steps, step:  0.17299E-02
 mylbfgs> Energy and RMS force=    -273.6091432        0.3651040806E-04 after     95 steps, step:  0.14545E-02
 mylbfgs> Energy and RMS force=    -273.6091433        0.4790461692E-04 after     96 steps, step:  0.24223E-02
 mylbfgs> Energy and RMS force=    -273.6091433        0.8909057426E-04 after     97 steps, step:  0.29295E-02
 mylbfgs> Energy and RMS force=    -273.6091434        0.4506081475E-04 after     98 steps, step:  0.14832E-02
 mylbfgs> Energy and RMS force=    -273.6091435        0.4256238233E-04 after     99 steps, step:  0.15723E-02
 mylbfgs> Energy and RMS force=    -273.6091436        0.8053597361E-04 after    100 steps, step:  0.27836E-02
 mylbfgs> Energy and RMS force=    -273.6091439        0.1379973024E-03 after    101 steps, step:  0.67309E-02
 mylbfgs> Energy and RMS force=    -273.6091446        0.2125076382E-03 after    102 steps, step:  0.17030E-01
 mylbfgs> Energy and RMS force=    -273.6091454        0.2548776633E-03 after    103 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091462        0.2812111041E-03 after    104 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091472        0.2514520557E-03 after    105 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091486        0.1866069005E-03 after    106 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091495        0.1871155152E-03 after    107 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091502        0.1416792784E-03 after    108 steps, step:  0.10399E-01
 mylbfgs> Energy and RMS force=    -273.6091503        0.2525706148E-03 after    109 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091508        0.1358556556E-03 after    110 steps, step:  0.48397E-02
 mylbfgs> Energy and RMS force=    -273.6091512        0.8024649026E-04 after    111 steps, step:  0.74277E-02
 mylbfgs> Energy and RMS force=    -273.6091517        0.8215849357E-04 after    112 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091520        0.1228079559E-03 after    113 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091523        0.8560134067E-04 after    114 steps, step:  0.16304E-01
 mylbfgs> Energy and RMS force=    -273.6091524        0.4041712754E-04 after    115 steps, step:  0.86435E-02
 mylbfgs> Energy and RMS force=    -273.6091524        0.8800552942E-04 after    116 steps, step:  0.16592E-01
 mylbfgs> Energy and RMS force=    -273.6091525        0.3298917993E-04 after    117 steps, step:  0.69986E-02
 mylbfgs> Energy and RMS force=    -273.6091525        0.2633463291E-04 after    118 steps, step:  0.47201E-03
 mylbfgs> Energy and RMS force=    -273.6091526        0.4003878475E-04 after    119 steps, step:  0.41626E-02
 mylbfgs> Energy and RMS force=    -273.6091527        0.5473201843E-04 after    120 steps, step:  0.73660E-02
 mylbfgs> Energy and RMS force=    -273.6091529        0.7344899451E-04 after    121 steps, step:  0.10179E-01
 mylbfgs> Energy and RMS force=    -273.6091529        0.7837469442E-04 after    122 steps, step:  0.11567E-01
 mylbfgs> Energy and RMS force=    -273.6091530        0.2620864279E-04 after    123 steps, step:  0.25409E-02
 mylbfgs> Energy and RMS force=    -273.6091531        0.2440899210E-04 after    124 steps, step:  0.51582E-02
 mylbfgs> Energy and RMS force=    -273.6091531        0.3045203242E-04 after    125 steps, step:  0.21800E-02
 mylbfgs> Energy and RMS force=    -273.6091532        0.2990798032E-04 after    126 steps, step:  0.56424E-02
 mylbfgs> Energy and RMS force=    -273.6091532        0.6343282136E-04 after    127 steps, step:  0.19271E-02
 mylbfgs> Energy and RMS force=    -273.6091532        0.3963548883E-04 after    128 steps, step:  0.95754E-03
 mylbfgs> Energy and RMS force=    -273.6091533        0.2953113141E-04 after    129 steps, step:  0.50159E-02
 mylbfgs> Energy and RMS force=    -273.6091533        0.3146952492E-04 after    130 steps, step:  0.86423E-02
 mylbfgs> Energy and RMS force=    -273.6091534        0.2515172382E-04 after    131 steps, step:  0.49802E-02
 mylbfgs> Energy and RMS force=    -273.6091534        0.1793331022E-04 after    132 steps, step:  0.40848E-02
 mylbfgs> Energy and RMS force=    -273.6091534        0.2318025080E-04 after    133 steps, step:  0.25151E-02
 mylbfgs> Energy and RMS force=    -273.6091535        0.2989641745E-04 after    134 steps, step:  0.28594E-02
 mylbfgs> Energy and RMS force=    -273.6091535        0.3001803081E-04 after    135 steps, step:  0.25147E-02
 mylbfgs> Energy and RMS force=    -273.6091536        0.5899568541E-04 after    136 steps, step:  0.34359E-02
 mylbfgs> Energy and RMS force=    -273.6091536        0.2680133480E-04 after    137 steps, step:  0.16685E-02
 mylbfgs> Energy and RMS force=    -273.6091537        0.3053759083E-04 after    138 steps, step:  0.28597E-02
 mylbfgs> Energy and RMS force=    -273.6091537        0.4560292441E-04 after    139 steps, step:  0.51126E-02
 mylbfgs> Energy and RMS force=    -273.6091539        0.6836537903E-04 after    140 steps, step:  0.70097E-02
 mylbfgs> Energy and RMS force=    -273.6091542        0.1052378765E-03 after    141 steps, step:  0.16972E-01
 mylbfgs> Energy and RMS force=    -273.6091547        0.1707557431E-03 after    142 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091554        0.1590378689E-03 after    143 steps, step:  0.19606E-01
 mylbfgs> Energy and RMS force=    -273.6091563        0.1356175790E-03 after    144 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091570        0.1010160527E-03 after    145 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091574        0.1388285134E-03 after    146 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091580        0.8218541719E-04 after    147 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091582        0.1222810300E-03 after    148 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091585        0.1718088684E-03 after    149 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091590        0.1406261858E-03 after    150 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091593        0.1489428038E-03 after    151 steps, step:  0.19059E-01
 mylbfgs> Energy and RMS force=    -273.6091597        0.1142519677E-03 after    152 steps, step:  0.20000E-01
 mylbfgs> Energy and RMS force=    -273.6091597        0.1322115429E-03 after    153 steps, step:  0.12143E-01
 mylbfgs> Energy and RMS force=    -273.6091599        0.7665568107E-04 after    154 steps, step:  0.70206E-02
 mylbfgs> Energy and RMS force=    -273.6091601        0.7034177671E-04 after    155 steps, step:  0.85441E-02
 mylbfgs> Energy and RMS force=    -273.6091603        0.8604681258E-04 after    156 steps, step:  0.12352E-01
 mylbfgs> Energy and RMS force=    -273.6091605        0.9163536995E-04 after    157 steps, step:  0.12239E-01
 mylbfgs> Energy and RMS force=    -273.6091605        0.9027511408E-04 after    158 steps, step:  0.13751E-01
 mylbfgs> Energy and RMS force=    -273.6091606        0.7129779716E-04 after    159 steps, step:  0.93184E-02
 mylbfgs> Energy and RMS force=    -273.6091606        0.4007014564E-04 after    160 steps, step:  0.42334E-02
 mylbfgs> Energy and RMS force=    -273.6091607        0.3620242429E-04 after    161 steps, step:  0.59933E-02
 mylbfgs> Energy and RMS force=    -273.6091607        0.3995378727E-04 after    162 steps, step:  0.67159E-02
 mylbfgs> Energy and RMS force=    -273.6091608        0.3995884234E-04 after    163 steps, step:  0.11972E-01
 mylbfgs> Energy and RMS force=    -273.6091608        0.3569696507E-04 after    164 steps, step:  0.90282E-02
 mylbfgs> Energy and RMS force=    -273.6091608        0.5126575875E-04 after    165 steps, step:  0.84571E-02
 mylbfgs> Energy and RMS force=    -273.6091608        0.1803034547E-04 after    166 steps, step:  0.12292E-02
 mylbfgs> Energy and RMS force=    -273.6091608        0.1300228611E-04 after    167 steps, step:  0.35543E-03
 mylbfgs> Energy and RMS force=    -273.6091609        0.1958078761E-04 after    168 steps, step:  0.20721E-02
 mylbfgs> Energy and RMS force=    -273.6091609        0.1978326074E-04 after    169 steps, step:  0.50964E-02
 mylbfgs> Energy and RMS force=    -273.6091609        0.1561194638E-04 after    170 steps, step:  0.18705E-02
 mylbfgs> Energy and RMS force=    -273.6091609        0.1132692275E-04 after    171 steps, step:  0.17572E-02
 mylbfgs> Energy and RMS force=    -273.6091609        0.8214351307E-05 after    172 steps, step:  0.10466E-02
 mylbfgs> Diagonal inverse Hessian elements are now         0.4630096993
 mylbfgs> Final energy is   -273.60916088000897    
 Minus side of path:                     173 steps. Energy=    -273.6091609       time=       0.50
 path> number of entries in EofS file=   226
 Frames will be dumped to path.xyz with probability     1.0000/    0.5814 steps on the plus/minus sides
 Transition state will be frame number     10

         E+        Ets - E+           Ets       Ets - E-           E-          S       D      gamma   ~N
     -273.6088480 0.11081E-03     -273.6087372 0.42367E-03     -273.6091609   2.284   1.398   2.116   7.088
 minpermdist> initial energy for structure A=                  -273.608848018388016 RMS=        0.000009829291960
 minpermdist> initial energy for structure B=                  -273.608849337519018 RMS=        0.000005826540690
isnewmin> minimum distance=    0.9080732412E-01
isnewmin> MINPOS=     4
 minpermdist> initial energy for structure A=                  -273.609160879918988 RMS=        0.000008213482362
 minpermdist> initial energy for structure B=                  -273.609160568013010 RMS=        0.000011132834922
 minpermdist> WARNING *** RMS for structure B is outside tolerance - QCI/DNEB endpoint alignment?
isnewmin> minimum distance=    0.1058003789E-01
isnewmin> MINPOS=     3
 orca_subp> ORCA numerical Hessian calculation
 orca_subp> ORCA numerical Hessian calculation
 orca_subp> ORCA numerical Hessian calculation
        Known (#4)                                              Known (#3)
 ido> Connected path found
  ts        E+         Ets - E+          Ets       Ets - E-          E-          S       D      gamma   ~N
   1     -273.6151510  0.10117E-01    -273.6050344  0.41300E-02    -273.6091644   1.777   1.777   4.545   3.300
   3     -273.6091644  0.42718E-03    -273.6087372  0.11232E-03    -273.6088495   1.398   1.398   2.116   7.088
   2     -273.6088495  0.19536E-02    -273.6068960  0.37957E-03    -273.6072755   1.746   1.746   2.195   6.835

 Number of TS in the path       =      3
 Number of cycles               =      3

 Elapsed time=                                10.86
 OPTIM> # of energy calls=                        129 time=           0.30 %=  2.7
 OPTIM> # of energy+gradient calls=              2900 time=           7.22 %= 66.4
 OPTIM> # of energy+gradient+Hessian calls=         9 time=           1.73 %= 16.0
