vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2026 01 04 
  18:38:16 
 
 
  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 
    
   
   
           0.62849807       0.56805690       0.50821071 
           0.66228575       0.61686951       0.38558367 
           0.66086838       0.64728807       0.61375258 
           0.68571828       0.45090034       0.53290501 
           0.40990322       0.55625161       0.49345438 
           0.58013105       0.60354875       0.24263758 
           0.53802519       0.70319391       0.34074514 
           0.61511930       0.79578925       0.17613146 
           0.72397538       0.72374825       0.20442410 
           0.68043102       0.82498031       0.30057354 
           0.65753498       0.81386719       0.56495755 
           0.54843957       0.76153010       0.62130537 
           0.63070682       0.88497420       0.75853331 
           0.73452864       0.79862663       0.75357359 
           0.62579804       0.74530894       0.80985567 
           0.63045876       0.30580442       0.46466650 
           0.69181869       0.39371932       0.36833830 
           0.78978697       0.22574867       0.41767173 
           0.78684367       0.26517294       0.56111957 
           0.84738558       0.35079223       0.46220438 
           0.35609098       0.55344736       0.48692818 
           0.60295049       0.66844063       0.30204121 
           0.65904317       0.75846472       0.24262219 
           0.62685692       0.75950655       0.63006724 
           0.65630392       0.79916530       0.74475690 
           0.69303098       0.36057383       0.45399926 
           0.78474794       0.29704978       0.47529555 
   
  
  
           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 
   
  
  
          0.62849807       0.56805690       0.50821071 
          0.66228575       0.61686951       0.38558367 
          0.66086838       0.64728807       0.61375258 
          0.68571828       0.45090034       0.53290501 
          0.40990322       0.55625161       0.49345438 
          0.58013105       0.60354875       0.24263758 
          0.53802519       0.70319391       0.34074514 
          0.61511930       0.79578925       0.17613146 
          0.72397538       0.72374825       0.20442410 
          0.68043102       0.82498031       0.30057354 
          0.65753498       0.81386719       0.56495755 
          0.54843957       0.76153010       0.62130537 
          0.63070682       0.88497420       0.75853331 
          0.73452864       0.79862663       0.75357359 
          0.62579804       0.74530894       0.80985567 
          0.63045876       0.30580442       0.46466650 
          0.69181869       0.39371932       0.36833830 
          0.78978697       0.22574867       0.41767173 
          0.78684367       0.26517294       0.56111957 
          0.84738558       0.35079223       0.46220438 
          0.35609098       0.55344736       0.48692818 
          0.60295049       0.66844063       0.30204121 
          0.65904317       0.75846472       0.24262219 
          0.62685692       0.75950655       0.63006724 
          0.65630392       0.79916530       0.74475690 
          0.69303098       0.36057383       0.45399926 
          0.78474794       0.29704978       0.47529555 
  
 
 
  
       6.94    7.03
       7.43    7.52
   
          7.57899788 
       2867.63296205 
      -4700.95865797 
        191.85749295 
       1815.17967868 
      -1806.54975558 
         -0.01836146 
       -467.78501146 
       2494.75543287 
        401.69277796 
        401.71113942 
        401.69889845 
   
  
  
       8.35    8.37
       8.35    8.37
   
        -18.13075171 
        -18.13585682 
        -18.13245341 
   
  
  
       6.66    6.67
       6.66    6.68
   
       -149.39605286 
       -149.40868201 
       -149.40026258 
   
  
  
       7.03    7.04
       7.03    7.04
   
       -158.01320569 
       -158.02594192 
       -158.01745110 
   
  
  
       7.00    7.01
       7.08    7.09
   
       -158.23079250 
       -158.24361314 
       -158.23506605 
   
  
  
       6.55    6.55
       7.20    7.20
   
       -145.66764249 
       -145.67946350 
       -145.67158283 
   
  
  
       6.54    6.55
       7.16    7.17
   
       -143.38152304 
       -143.39355130 
       -143.38553246 
   
  
  
       6.21    6.23
       6.77    6.79
   
       -143.12443089 
       -143.13684785 
       -143.12856988 
   
  
  
       6.44    6.44
       7.00    7.00
   
       -143.09408547 
       -143.10635557 
       -143.09817550 
   
  
  
       4.49    4.98
       5.00    5.60
   
       -143.09766909 
       -143.10975622 
       -143.10169814