vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2025 01 15 
  20:50:55 
 
 
  No title
       0
  Normal
  Normal (blocked Davidson)
   F  
       1
       2
       1
     200
       2
      -1
        0.00001000
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       0
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  Auto
       1
        0.20000000
       1
   F  
   F  
       1
 
 
  
   
    
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         274 
         275 
         276 
         277 
         278 
         279 
         280 
         281 
         282 
         283 
         284 
         285 
         286 
         287 
         288 
         289 
         290 
         291 
         292 
         293 
         294 
         295 
         296 
         297 
         298 
         299 
         300 
         301 
         302 
         303 
         304 
         305 
         306 
         307 
         308 
         309 
         310 
         311 
         312 
         313 
         314 
         315 
         316 
         317 
         318 
         319 
         320 
         321 
  
 
 
  
          1        1        1 
         0.00000000       0.00000000       0.00000000 
         1.00000000       0.00000000       0.00000000 
         0.00000000       1.00000000       0.00000000 
         0.00000000       0.00000000       1.00000000 
         0.00000000       0.00000000       0.00000000 
  
  
          0.00000000       0.00000000       0.00000000 
  
  
          1.00000000 
  
 
 
  
   No title
    F  
  
  
   normal
       400.00000000
       644.87300000
         0.00001000
       38
       10
      753
       -1
       -1
      1184.00000000
        0
        0
        0
        0
         0.00000000
   
         1
          0.20000000
          0.50000000
     T  
     T  
   
   
     T  
         -0.00050000     -0.00050000     -0.00050000     -0.00050000
      -100
         2
     F  
   
   
         0
         2
         1
   
   
         1
     F  
          1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000
      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000
      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000
      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000
      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000
      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000
      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000
      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000
      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000
      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000
      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000
      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000
      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000
      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000
      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000
      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000
      1.00000000
         -1.00000000
     F  
          0.00000000      0.00000000      1.00000000
     F  
          0.00000000      0.00000000      0.00000000
     F  
   
   
     F  
     F  
   
   
       200
        -5
         2
        400.00000000
    
      T  
      F  
           0.00000000
           0.00000000
           0.30000000
          4
           0.40000000
    
   
   
          0.40000000
          1.00000000
          0.10000000
          1.60000000
          1.00000000
    
          4
      F  
        -45
         100.00000000
          1
          1
          5
    
   
   
     F  
     F  
         0
          1.00000000
       -100.00000000   -100.00000000   -100.00000000
          0.00000000
   
  
  
       80
      140
       80
      160
      280
      160
    F  
  
  
        0
       -1
        0
        2
         0.00000000
        -0.02000000
        0
         0.50000000
        -3.00000000
         1.00000000
  
  
         0.00010000
         0.00010000
        1
        1
      256
        16.00000000
  
  
        2
         0.00001000
  
  
        0
         1.11000000      0.73000000      0.32000000      0.77000000
      301
        10.00000000
       -10.00000000
         0.00000000
  
  
        1
    F  
    F  
    F  
    F  
    F  
    F  
    F  
    F  
         0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000
  
  
        3
        4
       -1
    T  
    F  
    F  
    F  
    F  
    F  
  
  
        3
       -1
    F  
        28.08500000     16.00000000      1.00000000     12.01100000
         0.00000000      0.00000000      0.00000000      0.00000000
         1.00000000      1.00000000      1.00000000      1.00000000
    T  
  
   T  
   F  
       0
   F  
       0
  
   --
        1
    F  
   
    F  
    F  
    F  
    F  
    F  
        -1.00000000
        0
        0
         0.00000000
         0.00000000
         0.00000000
         1.00000000
         1.00000000
         1.00000000
         1.00000000
        1
        1
        1
    F  
    F  
    F  
        0
        0
    F  
         0.00000000
         0.00000000
        0
  
  
    F  
        -0.84910000
         0.12340000
         1.00000000
         0.00000000
  
  
        0
        13.50293501
         1.00000000
  
  
    F  
    F  
    F  
    F  
        0
         0.10000000
        -1.00000000
         0.00200000
        -0.10000000
         0.00000000
         0.00000000      0.00000000      0.00000000
         0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000
  
  
    F  
         0.00000000      0.00000000      0.00000000
    T  
    F  
    F  
    F  
    T  
        0
         0.00000000      0.00000000      0.00000000
         0.00000000      0.00000000      0.00000000
  
  
    F  
    F  
    F  
    F  
    T  
        0
       -1     0     0     0
    F  
    F  
    F  
    F  
    F  
    F  
        2
    F  
    F  
    F  
    F  
    F  
    F  
        -2.00000000
        -2.00000000
        -1.00000000
    F  
       -1
         0.00000000
        0
        0
       -1
       -1
       -1
      200
        1
        3
        4
        0
       -30.00000000
       -30.00000000
      -200.00000000
        0
        -0.10000000
    F  
    F  
    F  
    F  
    F  
    F  
    F  
        1
        1
        1
     2800
        0
       -1
       -1
         0.80000001
         1.00000000
  
  
         0.00000000
         0.00000000      0.00000000      0.00000000
         0.00000000
         0.00000000
         0.00000000
  
  
    F  
  
 
 
       321 
         4 
  
   ion
   element
   atomtype
   
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    C    4
    C    4
    C    4
    C    4
    C    4
    C    4
    C    4
    C    4
   
  
  
   type
   atomspertype
   element
   mass
   valence
   pseudopotential
   
     193Si     28.08500000      4.00000000  PAW_PBE Si 05Jan2001                  
      52O      16.00000000      6.00000000  PAW_PBE O 08Apr2002                   
      68H       1.00000000      1.00000000  PAW_PBE H 15Jun2001                   
       8C      12.01100000      4.00000000  PAW_PBE C 08Apr2002                   
   
  
 
 
  
   
          15.46772000       0.00000000       0.00000000 
           0.00000000      28.46772000       0.00000000 
           0.00000000       0.00000000      16.40601000 
   
      7224.07022841 
   
           0.06465077       0.00000000       0.00000000 
           0.00000000       0.03512751       0.00000000 
           0.00000000       0.00000000       0.06095327 
   
  
  
          0.99076389       0.36877332       0.27049496 
          0.99076389       0.43669113       0.18716162 
          0.11576389       0.36877332       0.35382829 
          0.11576389       0.43669113       0.10382829 
          0.99203992       0.64135507       0.26785056 
          0.99258353       0.16312708       0.18769406 
          0.11721670       0.64291666       0.35056174 
          0.11758121       0.16312964       0.10314192 
          0.99084080       0.23266394       0.26953801 
          0.99031566       0.57214511       0.18699282 
          0.11586367       0.23274105       0.35446794 
          0.11532062       0.57239694       0.10244501 
          0.99076389       0.50460893       0.27049496 
          0.99076389       0.30085552       0.18716162 
          0.11576389       0.50460893       0.35382829 
          0.11576389       0.30085552       0.10382829 
          0.99076389       0.36877332       0.60382829 
          0.99076389       0.43669113       0.52049496 
          0.11576389       0.36877332       0.68716162 
          0.11576389       0.43669113       0.43716162 
          0.99457999       0.64202228       0.60318795 
          0.99285170       0.16320290       0.52093166 
          0.11833425       0.64103657       0.68893694 
          0.11782821       0.16324368       0.43638091 
          0.99080057       0.23265878       0.60292350 
          0.49061813       0.57506878       0.52228134 
          0.11578469       0.23268410       0.68791429 
          0.11627799       0.57386472       0.43540361 
          0.99076389       0.50460893       0.60382829 
          0.99076389       0.30085552       0.52049496 
          0.11576389       0.50460893       0.68716162 
          0.11576389       0.30085552       0.43716162 
          0.99076389       0.36877332       0.93716162 
          0.99076389       0.43669113       0.85382829 
          0.11576389       0.36877332       0.02049496 
          0.11576389       0.43669113       0.77049496 
          0.99253481       0.64186834       0.93640411 
          0.99280200       0.16322125       0.85431655 
          0.11710666       0.64199106       0.02115410 
          0.11782715       0.16319426       0.76977335 
          0.99082784       0.23266875       0.93636364 
          0.49195149       0.57242080       0.85587472 
          0.11580644       0.23268034       0.02132679 
          0.11590745       0.57212603       0.77070650 
          0.99076389       0.50460893       0.93716162 
          0.99076389       0.30085552       0.85382829 
          0.11576389       0.50460893       0.02049496 
          0.11576389       0.30085552       0.77049496 
          0.24076389       0.36877332       0.27049496 
          0.24076389       0.43669113       0.18716162 
          0.36576389       0.36877332       0.35382829 
          0.36576389       0.43669113       0.10382829 
          0.24182121       0.64086670       0.26617165 
          0.24258146       0.16313186       0.18769214 
          0.36480659       0.64245606       0.35211302 
          0.36757466       0.16313548       0.10313799 
          0.24085431       0.23266346       0.26954323 
          0.24056122       0.57180289       0.18596728 
          0.36586606       0.23274035       0.35447136 
          0.36618654       0.57248151       0.10268418 
          0.24076389       0.50460893       0.27049496 
          0.24076389       0.30085552       0.18716162 
          0.36576389       0.50460893       0.35382829 
          0.36576389       0.30085552       0.10382829 
          0.24076389       0.36877332       0.60382829 
          0.24076389       0.43669113       0.52049496 
          0.36576389       0.36877332       0.68716162 
          0.36576389       0.43669113       0.43716162 
          0.24485641       0.64126513       0.60697918 
          0.24285050       0.16323868       0.52094661 
          0.36785636       0.63994494       0.69319025 
          0.36780902       0.16326039       0.43637325 
          0.24080861       0.23267595       0.60297968 
          0.24116454       0.57331175       0.52099234 
          0.36583015       0.23267419       0.68792103 
          0.36624558       0.57346800       0.43590957 
          0.24076389       0.50460893       0.60382829 
          0.24076389       0.30085552       0.52049496 
          0.36576389       0.50460893       0.68716162 
          0.36576389       0.30085552       0.43716162 
          0.24076389       0.36877332       0.93716162 
          0.24076389       0.43669113       0.85382829 
          0.36576389       0.36877332       0.02049496 
          0.36576389       0.43669113       0.77049496 
          0.24240145       0.64186944       0.93757241 
          0.24279982       0.16324083       0.85432846 
          0.36797913       0.64208418       0.02127918 
          0.36782431       0.16318313       0.76977414 
          0.24082709       0.23267631       0.93641268 
          0.24069769       0.57245706       0.85559496 
          0.36582925       0.23268220       0.02132607 
          0.36667231       0.57117925       0.77289367 
          0.24076389       0.50460893       0.93716162 
          0.24076389       0.30085552       0.85382829 
          0.36576389       0.50460893       0.02049496 
          0.36576389       0.30085552       0.77049496 
          0.49076389       0.36877332       0.27049496 
          0.49076389       0.43669113       0.18716162 
          0.61576389       0.36877332       0.35382829 
          0.61576389       0.43669113       0.10382829 
          0.49149930       0.64247373       0.26978474 
          0.49258423       0.16314563       0.18765723 
          0.61852446       0.64131917       0.35134365 
          0.61758799       0.16313615       0.10313447 
          0.49084080       0.23266394       0.26953801 
          0.49087997       0.57278535       0.18810579 
          0.61586367       0.23274105       0.35446794 
          0.61576486       0.57255634       0.10296804 
          0.49076389       0.50460893       0.27049496 
          0.49076389       0.30085552       0.18716162 
          0.61576389       0.50460893       0.35382829 
          0.61576389       0.30085552       0.10382829 
          0.49076389       0.36877332       0.60382829 
          0.49076389       0.43669113       0.52049496 
          0.61576389       0.36877332       0.68716162 
          0.61576389       0.43669113       0.43716162 
          0.49168308       0.64435846       0.60899068 
          0.49285050       0.16323519       0.52088301 
          0.61901345       0.64157671       0.68982130 
          0.61785507       0.16327007       0.43639016 
          0.49080057       0.23265878       0.60292350 
          0.99152555       0.57274359       0.52087956 
          0.61578469       0.23268410       0.68791429 
          0.61532620       0.57312794       0.43659592 
          0.49076389       0.50460893       0.60382829 
          0.49076389       0.30085552       0.52049496 
          0.61576389       0.50460893       0.68716162 
          0.61576389       0.30085552       0.43716162 
          0.49076389       0.36877332       0.93716162 
          0.49076389       0.43669113       0.85382829 
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         -3.00000000       0.00000000       0.00010000       0.00010000 
  
 
 
  
      33.44   33.44
      38.79   38.78
   
        517.66239122 
      39270.34342051 
     -81243.30566323 
        -82.54774858 
      36041.75636066 
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       5813.50184203 
       5813.52874153 
       5813.51080853 
   
  
  
      39.29   39.30
      39.30   39.31
   
       -916.00691877 
       -916.03963876 
       -916.01782543 
   
  
  
      37.81   37.81
      37.82   37.82
   
      -1824.87802589 
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      38.28   38.28
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      -1868.18397198 
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      41.73   41.73
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      37.91   37.90
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      -1769.43253838 
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      33.39   33.38
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      38.43   38.41
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      34.23   34.23
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      36.14   36.13
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      40.28   40.27
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      34.96   34.96
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      37.90   37.90
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      36.83   36.82
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      38.56   38.56
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      34.50   34.49
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      36.57   36.56
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      38.96   38.95
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      37.66   37.66
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      36.79   36.79
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      41.45   41.44
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      34.40   34.39
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      34.05   34.06
      37.24   37.25
   
      -1765.26712344 
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         -0.00885760      -0.09718350       0.05745844 
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         -0.00036632      -0.01350841       0.00030010 
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         -0.00527915       0.00062834      -0.00156857 
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         -0.00477354       0.00507384      -0.00097047 
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         -0.00230542       0.01325623      -0.03319613 
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         -0.00480501       0.01302763       0.01900898 
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          0.01023461      -0.01189129      -0.01605629 
          0.00172360      -0.00748486      -0.01906648 
         -0.00592464       0.00197356      -0.02111442 
         -0.00026834       0.00243447       0.00076181 
         -0.00740425      -0.01769394      -0.01473858 
         -0.00434288       0.02234242       0.00484022 
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         -0.03978018       0.00916961       0.00752539 
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         -0.00029904       0.00610229      -0.02062474 
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         -0.00085236       0.01624306      -0.01476096 
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         -0.01696104      -0.00028570       0.00358835 
         -0.00233779      -0.00521261      -0.00193855 
         -0.08197514      -0.15742222      -0.09407014 
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         -0.00486241       0.01407398      -0.03333435 
         -0.01883378       0.06356966       0.01902593 
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         -0.00223491       0.04365910      -0.05450608 
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         -0.07837157       0.53981013      -0.15632956 
         -0.00862564       0.00993745      -0.00410637 
         -0.03513915      -0.06803192      -0.01696969 
         -0.00385016      -0.00219449      -0.00285836 
          0.00385195       0.01457305       0.01090681 
         -0.00297801       0.00182590      -0.00078190 
         -0.00042035       0.00390374      -0.00216533 
         -0.01137133      -0.00143883       0.01620832 
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         -0.00306077       0.01510109      -0.04277349 
         -0.00305312      -0.08052744      -0.01932778 
         -0.00357239       0.01340973       0.02218301 
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          0.00932001      -0.01166855      -0.01605371 
          0.00440754      -0.00116548      -0.00782075 
         -0.00329715      -0.00933053      -0.00035809 
          0.00095222       0.00464827      -0.00077459 
         -0.00661474      -0.01538101      -0.01617705 
         -0.00420376       0.02349525       0.00493502 
          0.00037805       0.01136309       0.00382593 
          0.00132907       0.00025979      -0.00807057 
          0.00474676      -0.00029651      -0.00139151 
          0.02932887       0.00597055      -0.00023144 
          0.04746466      -0.12808720       0.13569195 
          0.00039817       0.00821187      -0.02227199 
         -0.01899402      -0.07091767      -0.05089413 
         -0.00392921       0.00844395       0.01856307 
          0.01412617      -0.01214068       0.00011214 
         -0.01152454      -0.00601154       0.00521772 
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         -0.00070511      -0.00750551       0.00050624 
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         -0.00083994       0.00664270       0.00620553 
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         -0.01583636       0.00113481       0.01022965 
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         -0.00568807       0.01242959      -0.02996947 
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         -0.00773853       0.00796585      -0.00338571 
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         -0.01106528      -0.00015877      -0.01154975 
         -0.00376765       0.02071991       0.00363259 
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         -0.00475536      -0.01973289       0.00087542 
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         -0.00811992      -0.00038426       0.01291921 
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          0.00031973       0.00573977      -0.01969701 
          0.00601805      -0.13014373      -0.13120956 
         -0.00093195       0.00874489       0.02181007 
          4.06094571      -5.92543724      -1.74038345 
         -0.00053752      -0.00428437       0.00539994 
          0.00156772      -0.00220969       0.00094662 
          0.00116315      -0.00150438      -0.00244463 
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         -0.00269921       0.00239148       0.00544838 
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         -0.00699561      -0.01492702      -0.00310070 
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         -0.01096954      -0.01552548       0.01621943 
         -0.00112929       0.00575639       0.01092024 
         -0.00012296       0.01567140       0.00104323 
         -0.05608905       0.05578971      -0.06070819 
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         -0.00126860      -0.00641895       0.00699429 
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         -0.00118194      -0.00692515       0.00033841 
         -0.00169151      -0.00516286       0.00558463 
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         -0.00085742      -0.00306131       0.00156545 
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         -0.48527646       2.58590727       0.09592277 
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          0.00548720       0.01946983       0.00111999 
         -0.00168461       0.01813220       0.00888767 
         -0.00852820       0.00080144       0.00981403 
         -0.00411064      -0.01318974      -0.01913571 
         -0.02779974       0.02952225      -0.04235391 
         -0.01005581      -0.00664566       0.00467279 
         -0.00832737       0.00924187       0.00051253 
         -0.00449935       0.01058904       0.00762695 
         -2.53555967       0.61700752      -0.50852343 
          0.08322643      -2.34566661       0.80611760 
         -3.81275547      -2.45744332      -0.13005606 
          1.96003721      -1.68848226      -1.99337201 
         -0.00059711       0.00284905       0.00041140 
         -0.00140525       0.00105383       0.00077833 
         -0.00127481       0.00241032       0.00163543 
         -0.00144463       0.00165537       0.00059082 
         -0.00192289       0.00136548       0.00153462 
         -0.00090650      -0.00006592       0.00067052 
         -0.00131690       0.00224270       0.00081682 
         -0.00207178       0.00163551       0.00035631 
         -0.00197000       0.00032057       0.00176742 
         -0.00151465       0.00266550       0.00018117 
         -0.00181569       0.00057441       0.00122733 
         -0.00159028       0.00098756       0.00075601 
         -0.00280963      -0.00055475      -0.00856135 
         -0.02188586       0.01136527       0.01011103 
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         -0.00938876      -0.00004241      -0.00584207 
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         -0.00389896      -0.00028171      -0.00281857 
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         -0.01819205       0.02030977       0.00150072 
         -0.00674039       0.01834581      -0.01273379 
         -0.00126121      -0.00284308      -0.00162966 
         -0.49011293      -0.16714014       0.13664458 
         -0.13327827       0.10173949      -0.23370370 
         -0.00069450       0.00165102       0.00084910 
         -0.00144943       0.00235199       0.00093470 
         -0.00055466       0.00007598       0.00078440 
         -0.00067767       0.00279389       0.00073358 
         -0.00117745       0.00088143       0.00103108 
         -0.00044340       0.00187380       0.00066459 
         -0.00011556       0.00236543       0.00032629 
         -0.00097814       0.00175959       0.00127788 
         -0.00009570       0.00164160       0.00061028 
         -0.00050453       0.00168455       0.00101594 
         -0.00125120       0.00160318       0.00124007 
         -0.00021151       0.00069745       0.00063198 
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         -0.77432933       0.33700922       0.08369218 
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         -0.00636623      -0.01971054       0.00573847 
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         -0.00086780       0.00116598      -0.00850243 
          0.00532234       0.00263699      -0.00008356 
         -2.94016304       1.87957880       1.84383387 
          0.00503645      -0.00357827      -0.00687413 
          0.00252127      -0.00265211       0.00303154 
          0.00676514       0.00142728      -0.00465742 
          3.58989054       1.55413596      -0.78246701 
         -2.36139260       2.51006013      -0.97988843 
          0.28531954       2.45918430       0.72345837 
          2.55677596      -2.35391092       1.28969361 
         -3.92856763      -1.45312601       1.05657618 
          1.44930664       0.60620213       1.47208106 
          2.16578272      -1.61221688      -1.46368691 
          2.51433516       1.59046269       0.07074537 
         -1.88512897       1.86239397       1.46048565 
         -1.02831918      -0.33506308      -1.60285297 
          0.04358448      -0.03316643       0.37952212 
         -0.14947829       0.08577928       0.42235411 
          0.40618172       0.20215264      -0.03474203 
          0.85167659      -0.17352757      -0.35738605 
         -0.49680230      -0.64667107      -0.04257660 
          0.00367159       0.08579254      -0.08003783 
          0.58088598       0.58986513       0.14576226 
         -0.71434791      -0.01571752       0.48286005 
         -0.25619387      -0.24335692      -0.01407622 
          0.05080743      -0.01478434       0.07172853 
         -0.51246619      -0.22863674       2.71740835 
          0.68536834       1.01680671      -2.65778622 
          1.10310363       0.33985310       0.56736968 
         -0.54613694       0.10185191      -0.28820863 
          0.76109784      -0.37033947      -0.20074259 
          0.00573694      -0.02798398      -0.03083698 
         -0.30801624       0.04174274      -0.30793897 
         -0.28152290       0.62387506      -0.34832843 
  
  
          3.02369650       0.47280211       0.81874109 
          0.47280205      -5.54767377       0.16194011 
          0.81874096       0.16193989     -17.09761795 
  
  
     -1765.26787109 
     -1765.29384496 
     -1765.27652904 
  
   1151.61 1151.49
  
   
    band
    kpoint
    spin
    eigene
    occ
    
     
      
         -21.4669    1.0000 
         -20.6777    1.0000 
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          -7.5285    1.0000 
          -7.4203    1.0000 
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