&CPMD
  DUMMY
  OPTIMIZE WAVEFUNCTION
  ODIIS 
  5
  CONVERGENCE ORBITAL
  3.0D-5
  MAXSTEP
  100
  STORE
  50
  STRUCTURE BONDS 
&END

&DFT
  NEWCODE
  FUNCTIONAL LDA 
  GC-CUTOFF
  0.5E-06
&END

&SYSTEM
  SYMMETRY
  2
  CELL
  45.00000 1.0  1.0  0  0  0
  CUTOFF
  30.0
&END

&ATOMS
*C_MT_LDA   KLEINMAN BYLANDER                    
   LMAX=P
   60
     6.992987912         1.521409937         2.319091376    
     7.077528727        -1.079660213         2.329732835    
     7.224464159        -1.978620996       -0.2731527103    
     6.946317478         2.322693263       -0.3361947187    
     6.861479596        0.1401383306        -1.916051981    
     5.293854191         4.356141128       -0.5988245230    
     5.074417808         2.873405815         3.610008025    
     4.368943593         4.950931255         1.945948440    
     3.183015188         1.602207110         5.033371299    
     5.179518404        -2.477455550         3.630109472    
     3.291240666        -1.184480353         5.063404858    
     5.669591322        -4.113803672       -0.4380361902    
     4.482785623        -4.558257873         2.016971972    
     4.195453703        -4.421950198        -2.606914399    
     5.014992114        0.5361320400E-01    -3.900092595    
     3.948859657        -2.386720813        -4.404008061    
     3.626761540         4.525457202        -2.742168030    
     3.456795234         2.305829966        -4.403154668    
     1.490701162         6.131517125        -2.420437962    
     2.110415361         6.185018982         2.227600235    
    0.8873303868         7.112394679        0.2276398400E-01
    0.6951926186         2.863631959         5.241656513    
    0.2156337189         5.146368612         3.918227130    
    -1.480203760         1.390016142         5.807226630    
    0.9840401295        -2.571842482         5.467495866    
    -1.280351232        -1.251939015         6.148601700    
     2.068786442        -5.674194979         2.125399102    
    0.5087960560        -4.811579117         4.107278318    
     1.848422564        -5.802795709        -2.509950203    
    0.8274958096        -6.564562767       -0.1697239246    
     1.522875023        -2.689133053        -5.567056390    
    0.2359056114        -4.848926639        -4.455489901    
     1.118437422         1.929796071        -5.674698052    
    0.1559757984       -0.5573551942        -6.244319737    
   -0.8966951284         5.601292849        -3.652270584    
    -1.051999682         3.544754288        -5.263901002    
    -1.756465440         6.889065375        0.4150127181    
    -2.213600688         5.625833429         2.753917889    
    -2.932692311         6.063169383        -1.857946055    
    -3.933007487         1.857434136         4.700079210    
    -4.265371710         3.870945338         2.944057972    
    -3.580845846        -2.461201661         5.507520968    
    -5.205459972       -0.5047984469         4.403657768    
    -2.709024891        -6.572258416         2.653101430    
    -1.866136890        -6.735594486        0.1014503456    
    -3.069445057        -4.605457795         4.094294262    
    -2.372544236        -4.785554505        -4.070774546    
    -3.477046328        -5.769995396        -1.796767629    
    -2.570861522       -0.5323285514        -5.970333393    
    -3.317235983         1.995658548        -5.320490105    
    -3.800675997        -2.587427410        -4.867022893    
    -4.939632608         4.373449058        -1.690356521    
    -5.740750444         3.375114401        0.7382997562    
    -5.242687179         2.398790721        -3.546883628    
    -6.562241415        -1.057490935         2.158665397    
    -6.322486687        -3.613291863         1.318841129    
    -5.602001368        -4.126297170        -1.115678077    
    -5.747258042        -2.160832431        -3.020265914    
    -6.782986204        0.9100982471        0.3219480536    
    -6.443610887        0.2864079277        -2.325584464    
&END
