vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2026 01 04 
  18:38:12 
 
 
  No title
       0
  Normal
  Normal (blocked Davidson)
   F  
       2
       2
       1
     200
       2
      -1
        0.00001000
       -0.02000000
       0
       2
       1
      400.00000000
        1.11000000      0.73000000      0.32000000      0.77000000
        1.00000000
        0.00100000      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      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000
      0.10700000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000
  Auto
       1
        0.20000000
       1
   F  
   F  
       1
 
 
  
   
    
           14.00000000       0.00000000       0.00000000 
            0.00000000      12.00000000       0.00000000 
            0.00000000       0.00000000      12.00000000 
    
       2016.00000000 
    
            0.07142857       0.00000000       0.00000000 
            0.00000000       0.08333333       0.00000000 
            0.00000000       0.00000000       0.08333333 
    
   
   
           0.61288283       0.56814507       0.50744383 
           0.66100403       0.61468603       0.38537107 
           0.66098092       0.64753733       0.61111044 
           0.67921944       0.45066028       0.53323912 
           0.50652655       0.56293088       0.50372915 
           0.58162992       0.60119800       0.24010439 
           0.53626741       0.69846500       0.33852309 
           0.61385649       0.79539432       0.17682004 
           0.72353286       0.72529783       0.20568330 
           0.67737142       0.82414430       0.30260605 
           0.65599598       0.81493586       0.56479801 
           0.54758059       0.76043633       0.62103980 
           0.62897696       0.88372843       0.75915766 
           0.73381825       0.79923675       0.75263363 
           0.62611036       0.74355409       0.80907409 
           0.62778086       0.30419563       0.46275832 
           0.68906368       0.39447606       0.36843488 
           0.78925844       0.22846095       0.41761093 
           0.78353319       0.26573899       0.56145361 
           0.84393397       0.35414980       0.46506469 
           0.31432755       0.55390670       0.48163567 
           0.60250146       0.66611739       0.30087482 
           0.65774908       0.75818074       0.24325325 
           0.62598113       0.75938803       0.62953150 
           0.65568263       0.79855049       0.74441932 
           0.68959581       0.36051607       0.45393695 
           0.78211990       0.29878839       0.47604710 
   
  
  
           1 
           2 
           3 
           4 
           5 
           6 
           7 
           8 
           9 
          10 
          11 
          12 
          13 
          14 
          15 
          16 
          17 
          18 
          19 
          20 
          21 
          22 
          23 
          24 
          25 
          26 
          27 
  
 
 
  
          1        2        2 
         0.00000000       0.00000000       0.00000000 
         1.00000000       0.00000000       0.00000000 
         0.00000000       0.50000000       0.00000000 
         0.00000000       0.00000000       0.50000000 
         0.00000000       0.00000000       0.00000000 
  
  
          0.00000000       0.00000000       0.00000000 
          0.00000000       0.50000000       0.00000000 
          0.00000000       0.00000000       0.50000000 
          0.00000000       0.50000000       0.50000000 
  
  
          0.25000000 
          0.25000000 
          0.25000000 
          0.25000000 
  
 
 
  
   No title
    F  
  
  
   normal
       400.00000000
       644.87300000
         0.00001000
       38
       10
       48
       -1
       -1
        63.00000000
        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
   
   
         2
     F  
          0.00100000      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      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000
      0.10700000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000
          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
           0.00000005
           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
   
  
  
       70
       60
       60
      140
      120
      120
    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
  
  
        4
        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
        44.80000000
         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  
  
 
 
        27 
         4 
  
   ion
   element
   atomtype
   
    Si   1
    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
    C    4
    C    4
    C    4
    C    4
    C    4
    C    4
   
  
  
   type
   atomspertype
   element
   mass
   valence
   pseudopotential
   
       1Si     28.08500000      4.00000000  PAW_PBE Si 05Jan2001                  
       3O      16.00000000      6.00000000  PAW_PBE O 08Apr2002                   
      17H       1.00000000      1.00000000  PAW_PBE H 15Jun2001                   
       6C      12.01100000      4.00000000  PAW_PBE C 08Apr2002                   
   
  
 
 
  
   
          14.00000000       0.00000000       0.00000000 
           0.00000000      12.00000000       0.00000000 
           0.00000000       0.00000000      12.00000000 
   
      2016.00000000 
   
           0.07142857       0.00000000       0.00000000 
           0.00000000       0.08333333       0.00000000 
           0.00000000       0.00000000       0.08333333 
   
  
  
          0.61288283       0.56814507       0.50744383 
          0.66100403       0.61468603       0.38537107 
          0.66098092       0.64753733       0.61111044 
          0.67921944       0.45066028       0.53323912 
          0.50652655       0.56293088       0.50372915 
          0.58162992       0.60119800       0.24010439 
          0.53626741       0.69846500       0.33852309 
          0.61385649       0.79539432       0.17682004 
          0.72353286       0.72529783       0.20568330 
          0.67737142       0.82414430       0.30260605 
          0.65599598       0.81493586       0.56479801 
          0.54758059       0.76043633       0.62103980 
          0.62897696       0.88372843       0.75915766 
          0.73381825       0.79923675       0.75263363 
          0.62611036       0.74355409       0.80907409 
          0.62778086       0.30419563       0.46275832 
          0.68906368       0.39447606       0.36843488 
          0.78925844       0.22846095       0.41761093 
          0.78353319       0.26573899       0.56145361 
          0.84393397       0.35414980       0.46506469 
          0.31432755       0.55390670       0.48163567 
          0.60250146       0.66611739       0.30087482 
          0.65774908       0.75818074       0.24325325 
          0.62598113       0.75938803       0.62953150 
          0.65568263       0.79855049       0.74441932 
          0.68959581       0.36051607       0.45393695 
          0.78211990       0.29878839       0.47604710 
  
 
 
  
       3.19    3.29
       3.67    3.77
   
          7.57899788 
       2895.90732123 
      -4737.82954767 
        191.57874418 
       1815.17967868 
      -1806.54975558 
          0.00366804 
       -444.16668782 
       2494.75543287 
        416.45785181 
        416.45418376 
        416.45662913 
   
  
  
       8.17    8.18
       8.17    8.18
   
         -8.09829227 
         -8.10753931 
         -8.10137462 
   
  
  
       6.74    6.75
       6.74    6.75
   
       -147.22196210 
       -147.23467077 
       -147.22619832 
   
  
  
       6.87    6.88
       6.87    6.88
   
       -156.36252335 
       -156.37950021 
       -156.36818230 
   
  
  
       7.44    7.45
       7.51    7.52
   
       -156.58570428 
       -156.60285315 
       -156.59142057 
   
  
  
       5.63    5.64
       6.18    6.19
   
       -140.07583432 
       -140.08751844 
       -140.07972902 
   
  
  
       6.20    6.20
       6.74    6.75
   
       -141.71294302 
       -141.73069229 
       -141.71885944 
   
  
  
       6.18    6.19
       6.75    6.76
   
       -140.79076275 
       -140.80310773 
       -140.79487774 
   
  
  
       5.75    5.76
       6.34    6.35
   
       -141.78979531 
       -141.80190062 
       -141.79383041 
   
  
  
       5.95    5.97
       6.45    6.48
   
       -142.09566143 
       -142.10768336 
       -142.09966874