vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2025 09 28 
  22:04:18 
 
 
  No title
       0
  Normal
  Normal (blocked Davidson)
   F  
       1
       2
       1
      60
       2
      -1
        0.00001000
       -0.02000000
       0
       2
       1
      400.00000000
        0.77000000      0.72000000      0.32000000
  Auto
       1
        0.20000000
       1
   F  
   F  
       1
 
 
  
   
    
           10.00000000       0.00000000       0.00000000 
            0.00000000      10.00000000       0.00000000 
            0.00000000       0.00000000      10.00000000 
    
       1000.00000000 
    
            0.10000000       0.00000000       0.00000000 
            0.00000000       0.10000000       0.00000000 
            0.00000000       0.00000000       0.10000000 
    
   
   
           0.37989888       0.30915792       0.44364083 
           0.50933966       0.37711826       0.50987905 
           0.63609881       0.38872329       0.42125402 
           0.72704639       0.45161649       0.49780226 
           0.69331301       0.26750586       0.38008329 
           0.60815537       0.45918720       0.31159538 
           0.39633333       0.17370421       0.40781033 
           0.28291493       0.31406758       0.53622584 
           0.53781470       0.30645221       0.62048690 
           0.34707608       0.37589302       0.33395502 
           0.47096130       0.55907905       0.52831337 
           0.50572742       0.79593139       0.47003547 
   
  
  
           1 
           2 
           3 
           4 
           5 
           6 
           7 
           8 
           9 
          10 
          11 
          12 
  
 
 
  
          2        2        2 
         0.00000000       0.00000000       0.00000000 
         0.50000000       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 
          0.50000000       0.00000000       0.00000000 
          0.00000000       0.50000000       0.00000000 
          0.00000000       0.00000000       0.50000000 
          0.50000000       0.50000000       0.00000000 
          0.00000000       0.50000000       0.50000000 
          0.50000000       0.00000000       0.50000000 
          0.50000000       0.50000000       0.50000000 
  
  
          0.12500000 
          0.12500000 
          0.12500000 
          0.12500000 
          0.12500000 
          0.12500000 
          0.12500000 
          0.12500000 
  
 
 
  
   No title
    F  
  
  
   normal
       400.00000000
       644.87300000
         0.00001000
       38
       10
       40
       -1
       -1
        63.00000000
        0
        0
        0
        0
         0.00000000
   
         1
          0.20000000
          0.50000000
     T  
     T  
   
   
     T  
         -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
     F  
          0.00000000      0.00000000      1.00000000
     F  
          0.00000000      0.00000000      0.00000000
     F  
   
   
     F  
     F  
   
   
        60
        -5
         2
        400.00000000
    
      T  
      F  
           0.00000000
           0.00000006
           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
   
  
  
       50
       50
       50
      100
      100
      100
    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
         0.77000000      0.72000000      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
  
  
        4
        4
       -1
    T  
    F  
    F  
    F  
    F  
    F  
  
  
        3
       -1
    F  
        12.01100000     18.99800000      1.00000000
         0.00000000      0.00000000      0.00000000
         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
        50.00000000
         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  
  
 
 
        12 
         3 
  
   ion
   element
   atomtype
   
    C    1
    C    1
    C    1
    F    2
    F    2
    F    2
    F    2
    F    2
    F    2
    F    2
    H    3
    H    3
   
  
  
   type
   atomspertype
   element
   mass
   valence
   pseudopotential
   
       3C      12.01100000      4.00000000  PAW_PBE C 08Apr2002                   
       7F      18.99800000      7.00000000  PAW_PBE F 08Apr2002                   
       2H       1.00000000      1.00000000  PAW_PBE H 15Jun2001                   
   
  
 
 
  
   
          10.00000000       0.00000000       0.00000000 
           0.00000000      10.00000000       0.00000000 
           0.00000000       0.00000000      10.00000000 
   
      1000.00000000 
   
           0.10000000       0.00000000       0.00000000 
           0.00000000       0.10000000       0.00000000 
           0.00000000       0.00000000       0.10000000 
   
  
  
          0.37989888       0.30915792       0.44364083 
          0.50933966       0.37711826       0.50987905 
          0.63609881       0.38872329       0.42125402 
          0.72704639       0.45161649       0.49780226 
          0.69331301       0.26750586       0.38008329 
          0.60815537       0.45918720       0.31159538 
          0.39633333       0.17370421       0.40781033 
          0.28291493       0.31406758       0.53622584 
          0.53781470       0.30645221       0.62048690 
          0.34707608       0.37589302       0.33395502 
          0.47096130       0.55907905       0.52831337 
          0.50572742       0.79593139       0.47003547 
  
 
 
  
       4.65    4.70
       4.77    4.83
   
         15.25316852 
       2445.84609888 
      -6777.41878708 
        303.53110387 
       4104.28886790 
      -4141.72589677 
         -0.00314073 
       -369.99352938 
       5082.48689363 
        662.26477883 
        662.26791956 
        662.26582574 
   
  
  
       5.28    5.28
       5.28    5.28
   
         97.06906352 
         97.06363191 
         97.06725299 
   
  
  
       4.38    4.40
       4.38    4.40
   
        -54.28105646 
        -54.22543625 
        -54.26251639 
   
  
  
       4.37    4.37
       4.37    4.37
   
        -58.94077766 
        -58.88441176 
        -58.92198902 
   
  
  
       4.75    4.75
       4.78    4.79
   
        -59.02344523 
        -58.96707606 
        -59.00465551 
   
  
  
       4.31    4.31
       4.44    4.44
   
        -56.54600195 
        -56.48961398 
        -56.52720596 
   
  
  
       4.30    4.31
       4.43    4.43
   
        -56.46285832 
        -56.40646648 
        -56.44406104 
   
  
  
       4.36    4.37
       4.48    4.49
   
        -56.47869553 
        -56.42230169 
        -56.45989759 
   
  
  
       4.34    4.37
       4.46    4.49
   
        -56.48156150 
        -56.42516697 
        -56.46276332 
   
  
  
       4.28    4.29
       4.40    4.41
   
        -56.48201644 
        -56.42562198 
        -56.46321828 
   
  
  
       4.24    4.26
       4.36    4.38
   
        -56.48246962 
        -56.42607532 
        -56.46367152 
   
  
  
       4.23    4.26
       4.35    4.39
   
        -56.48297847 
        -56.42658417 
        -56.46418037 
   
  
  
       3.85    3.86
       3.98    3.99
   
        -56.48373809 
        -56.42734380 
        -56.46493999 
   
  
  
       4.04    4.05
       4.16    4.18
   
        -56.48412009 
        -56.42772586 
        -56.46532201 
   
  
  
       3.52    3.55
       3.65    3.67
   
        -56.48442241 
        -56.42802824 
        -56.46562436 
   
  
  
       3.39    3.39
       3.51    3.52
   
        -56.48450086 
        -56.42810671 
        -56.46570281 
   
  
  
       3.12    3.13
       3.24    3.25
   
        -56.48456325 
        -56.42816909 
        -56.46576520 
   
  
  
       3.12    3.13
       3.24    3.26
   
        -56.48458271 
        -56.42818855 
        -56.46578466 
   
  
  
       2.67    2.74
       2.80    2.86
   
        -56.48459882 
        -56.42820467 
        -56.46580077 
   
  
  
       2.07    2.24
       2.17    2.35
   
         15.25316852 
       2445.84609888 
      -6837.80354636 
        308.04807383 
       5546.41108624 
      -5583.84820014 
         -0.05639415 
      -1032.82178249 
       5082.48689363 
        -56.48460204 
        -56.42820789 
        -56.46580399