vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2025 05 10 
  23:57:39 
 
 
  No title
       0
  Normal
  Normal (blocked Davidson)
   F  
       1
       2
       1
      60
       2
      -1
        0.00001000
       -0.02000000
       0
       2
       1
      318.61400000
        0.82000000      0.32000000
  Auto
       1
        0.20000000
       1
   F  
   F  
       1
 
 
  
   
    
            6.72000000       0.00000000       0.00000000 
            0.00000000       5.93204000       0.00000000 
            0.00000000       0.00000000       4.23931000 
    
        168.99292363 
    
            0.14880952       0.00000000       0.00000000 
            0.00000000       0.16857607       0.00000000 
            0.00000000       0.00000000       0.23588744 
    
   
   
           0.58506704       0.46868807       0.42927787 
           0.49068693       0.30387268       0.43879792 
           0.74778128       0.47323043       0.56643544 
           0.43467073       0.69743977       0.42383181 
           0.73993606       0.47258021       0.27034596 
   
  
  
           1 
           2 
           3 
           4 
           5 
  
 
 
  
          2        3        3 
         0.00000000       0.00000000       0.00000000 
         0.50000000       0.00000000       0.00000000 
         0.00000000       0.33333333       0.00000000 
         0.00000000       0.00000000       0.33333333 
         0.00000000       0.00000000       0.00000000 
  
  
          0.00000000       0.00000000       0.00000000 
          0.50000000       0.00000000       0.00000000 
          0.00000000       0.33333333       0.00000000 
          0.50000000       0.33333333       0.00000000 
          0.00000000       0.00000000       0.33333333 
          0.50000000       0.00000000       0.33333333 
          0.00000000       0.33333333       0.33333333 
          0.00000000      -0.33333333       0.33333333 
          0.50000000       0.33333333       0.33333333 
          0.50000000      -0.33333333       0.33333333 
  
  
          0.05555556 
          0.05555556 
          0.11111111 
          0.11111111 
          0.11111111 
          0.11111111 
          0.11111111 
          0.11111111 
          0.11111111 
          0.11111111 
  
 
 
  
   No title
    F  
  
  
   normal
       318.61400000
       535.51400000
         0.00001000
       38
       10
        9
       -1
       -1
         7.00000000
        0
        0
        0
        0
         0.00000000
   
         1
          0.20000000
          0.50000000
     T  
     T  
   
   
     T  
         -0.00050000     -0.00050000
      -100
         2
     F  
   
   
         0
         2
         1
   
   
         1
     F  
          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  
   
   
        60
        -5
         2
        318.61400000
    
      T  
      F  
           0.00000000
           0.00000028
           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
   
  
  
       30
       28
       20
       60
       56
       40
    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
         0.82000000      0.32000000
      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  
        10.81100000      1.00000000
         0.00000000      0.00000000
         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
        20.27915084
         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
       60
        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  
  
 
 
         5 
         2 
  
   ion
   element
   atomtype
   
    B    1
    H    2
    H    2
    H    2
    H    2
   
  
  
   type
   atomspertype
   element
   mass
   valence
   pseudopotential
   
       1B      10.81100000      3.00000000  PAW_PBE B 06Sep2000                   
       4H       1.00000000      1.00000000  PAW_PBE H 15Jun2001                   
   
  
 
 
  
   
           6.72000000       0.00000000       0.00000000 
           0.00000000       5.93204000       0.00000000 
           0.00000000       0.00000000       4.23931000 
   
       168.99292363 
   
           0.14880952       0.00000000       0.00000000 
           0.00000000       0.16857607       0.00000000 
           0.00000000       0.00000000       0.23588744 
   
  
  
          0.58506704       0.46868807       0.42927787 
          0.49068693       0.30387268       0.43879792 
          0.74778128       0.47323043       0.56643544 
          0.43467073       0.69743977       0.42383181 
          0.73993606       0.47258021       0.27034596 
  
 
 
  
       0.54    0.68
       0.58    0.72
   
          1.35351575 
          9.51814732 
        -84.05701235 
         15.01641344 
         52.03597525 
        -51.21616644 
         -0.00588161 
        -57.92465579 
        120.98661678 
          5.70695235 
          5.71283395 
          5.70891288 
   
  
  
       1.07    1.09
       1.07    1.09
   
        -16.81567290 
        -16.81604722 
        -16.81579767 
   
  
  
       1.07    1.09
       1.07    1.10
   
        -17.87810292 
        -17.85154049 
        -17.86924878 
   
  
  
       1.42    1.44
       1.43    1.44
   
        -17.88392973 
        -17.85748067 
        -17.87511337 
   
  
  
       1.13    1.14
       1.15    1.17
   
        -17.88393070 
        -17.85748165 
        -17.87511435 
   
  
  
       1.18    1.19
       1.23    1.25
   
        -16.75709704 
        -16.73029347 
        -16.74816252 
   
  
  
       1.29    1.31
       1.34    1.35
   
        -16.36550692 
        -16.35519593 
        -16.36206992 
   
  
  
       1.08    1.09
       1.12    1.14
   
        -16.34564996 
        -16.33264929 
        -16.34131640 
   
  
  
       1.23    1.25
       1.28    1.29
   
        -16.34328761 
        -16.33191405 
        -16.33949643 
   
  
  
       0.92    0.93
       0.97    0.98
   
        -16.34546005 
        -16.33480568 
        -16.34190859 
   
  
  
       0.91    0.92
       0.95    0.97
   
        -16.34651400 
        -16.33507380 
        -16.34270060 
   
  
  
       1.07    1.09
       1.12    1.14
   
        -16.34726461 
        -16.33575315 
        -16.34342746 
   
  
  
       0.85    0.87
       0.90    0.92
   
        -16.34753687 
        -16.33566740 
        -16.34358038 
   
  
  
       1.11    1.17
       1.14    1.21
   
        -16.34754701 
        -16.33575977 
        -16.34361793 
   
  
  
       0.49    0.69
       0.51    0.72
   
          1.35351575 
          9.51814732 
       -101.49863837 
         16.61483953 
        244.72982583 
       -244.01076994 
         -0.01171629 
        -64.02936445 
        120.98661678 
        -16.34754384 
        -16.33582755 
        -16.34363841