&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
     6.940685568         1.494822397         2.381322399    
     7.050845958        -1.108383920         2.382645933    
     7.318806578        -2.008619112       -0.2112273020    
     6.925444552         2.301981869       -0.2698614827    
     6.902475827        0.1109730566        -1.844470034    
     5.258336044         4.310091934       -0.5679188424    
     4.969646354         2.793631960         3.618946274    
     4.299533104         4.896328218         1.960505122    
     3.027544010         1.466909708         4.926242314    
     5.159097655        -2.557557039         3.628390657    
     3.124173828        -1.317978414         4.918058222    
     5.895835796        -4.231258516       -0.4276308771    
     4.667003694        -4.708173872         2.011420812    
     4.523076012        -4.651731091        -2.657803304    
     5.013650948       -0.4088913980E-01    -3.780765879    
     4.176561669        -2.550752098        -4.382922891    
     3.533609109         4.399180657        -2.688868771    
     3.290745330         2.099741361        -4.183334250    
     1.412471071         6.015276399        -2.411575724    
     2.049144610         6.136818671         2.204575250    
    0.8570784089         7.107517831       -0.3801237200E-02
    0.5653028422         2.771137356         5.156226538    
    0.1335459196         5.127489477         3.883730068    
    -1.603947358         1.343560015         5.730917884    
    0.7720863940        -2.743196324         5.171721952    
    -1.481055147        -1.412646035         5.844402647    
     2.347120158        -5.908531053         2.069809915    
    0.4346206996        -5.048170928         3.799192277    
     2.197980049        -6.133399159        -2.584311035    
     1.133924713        -6.751389554       -0.2308090761    
     1.728402025        -2.927221102        -5.424161574    
    0.5437910494        -5.191792184        -4.483277091    
    0.8035044714         1.606613729        -5.217487762    
    0.6386430610E-01   -0.9395033334        -5.413418158    
    -1.003045982         5.502681637        -3.601510923    
    -1.275339351         3.364629178        -5.133277478    
    -1.786159790         7.020490194        0.3955335100    
    -2.254375474         5.717596695         2.750569149    
    -3.002297160         6.231314664        -1.848622426    
    -4.056730083         2.028357805         4.778195616    
    -4.361137575         4.039290998         2.996694692    
    -3.875777263        -2.371897577         5.207014352    
    -5.428304363       -0.2653797137         4.467151062    
    -1.987009831        -5.703500254         2.715793361    
    -1.550090924        -6.508687625        0.1375669222    
    -4.131492797        -4.323209764         3.372639980    
    -2.045820085        -4.843826026        -4.202325490    
    -3.101643513        -5.521539889        -1.807770914    
    -4.088974549       -0.3085204629        -6.522459383    
    -3.761681857         2.167552463        -5.485011761    
    -2.767535657        -2.073387376        -4.973945592    
    -5.094471516         4.632811298        -1.658789054    
    -5.878106866         3.592585717        0.7995595858    
    -5.486866596         2.765827672        -3.531875900    
    -6.622388527       -0.8274742231         2.166201320    
    -5.797807239        -3.361499592         1.415597631    
    -5.121471124        -3.827928476        -1.106693355    
    -5.218867194        -1.727310943        -2.771201436    
    -6.887736811         1.112886673        0.3646091881    
    -6.374610263        0.5397128876        -2.242155707    
&END
