MAXTSENERGY -400.0
MAXBARRIER 20.0
NOCISTRANS
CHECKCHIRALITY
NEWNEB 30 400 0.001
NEWCONNECT 50 3 1.0 40.0 61 3.0 0.001
NEBK 5.0
PERMDIST
NOPERMPROCHIRAL
INTINTERP 50
INTMINPERM 
DIJKSTRA EXP
MAXERISE 1.0D-4 1.0D0
EDIFFTOL  1.0D-5
GEOMDIFFTOL  0.1D0
BFGSTS 2000 5 100 0.002 100
NOIT
UPDATES 10000
MAXSTEP  0.1
TRAD     0.5
MINMAX 1.0D-4
MAXMAX   1.0
BFGSMIN 1.0D-6
CONVERGE 0.1 1.0D-6
PUSHOFF 0.1
STEPS 400
BFGSSTEPS 10000
MAXBFGS 0.1
NAB start
POINTS

