vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2025 11 29 
  14:13:08 
 
 
  No title
       0
  Normal
  Normal (blocked Davidson)
   F  
       1
       2
       1
     200
       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       8.00000000       0.00000000 
            0.00000000       0.00000000       8.00000000 
    
        640.00000000 
    
            0.10000000       0.00000000       0.00000000 
            0.00000000       0.12500000       0.00000000 
            0.00000000       0.00000000       0.12500000 
    
   
   
           0.38524877       0.42911298       0.53276921 
           0.44232057       0.52596027       0.39017122 
           0.58288705       0.52006017       0.32754094 
           0.35308407       0.57675915       0.27592000 
           0.26252179       0.48831187       0.57437412 
           0.36953867       0.26289187       0.49156581 
           0.61872802       0.66881675       0.25790250 
           0.67029439       0.48270676       0.45094460 
           0.59671323       0.40109942       0.20467303 
           0.46490466       0.43519157       0.66954753 
           0.47411448       0.82694039       0.56429197 
           0.42803444       0.90022317       0.57814076 
   
  
  
           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 
          0.50000000       0.00000000       0.50000000 
          0.00000000       0.50000000       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  
   
   
       200
        -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
       40
       40
      100
       80
       80
    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
        32.00000000
         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
      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  
  
 
 
        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       8.00000000       0.00000000 
           0.00000000       0.00000000       8.00000000 
   
       640.00000000 
   
           0.10000000       0.00000000       0.00000000 
           0.00000000       0.12500000       0.00000000 
           0.00000000       0.00000000       0.12500000 
   
  
  
          0.38524877       0.42911298       0.53276921 
          0.44232057       0.52596027       0.39017122 
          0.58288705       0.52006017       0.32754094 
          0.35308407       0.57675915       0.27592000 
          0.26252179       0.48831187       0.57437412 
          0.36953867       0.26289187       0.49156581 
          0.61872802       0.66881675       0.25790250 
          0.67029439       0.48270676       0.45094460 
          0.59671323       0.40109942       0.20467303 
          0.46490466       0.43519157       0.66954753 
          0.47411448       0.82694039       0.56429197 
          0.42803444       0.90022317       0.57814076 
  
 
 
  
       4.33    4.39
       4.39    4.45
   
         23.83307581 
       1502.50540093 
      -5862.95612964 
        304.12220489 
       4104.28886790 
      -4141.72589677 
         -0.01775732 
       -391.91633292 
       5082.48689363 
        620.62032652 
        620.63808383 
        620.62624562 
   
  
  
       5.14    5.17
       5.14    5.18
   
         39.21658984 
         39.22412397 
         39.21910122 
   
  
  
       4.20    4.21
       4.20    4.21
   
        -61.57091573 
        -61.54013812 
        -61.56065653 
   
  
  
       4.23    4.23
       4.23    4.23
   
        -63.28168100 
        -63.22563814 
        -63.26300004 
   
  
  
       4.42    4.43
       4.45    4.45
   
        -63.32674318 
        -63.27054552 
        -63.30801063 
   
  
  
       4.23    4.23
       4.31    4.31
   
        -60.48139080 
        -60.42528320 
        -60.46268827 
   
  
  
       4.43    4.43
       4.50    4.51
   
        -60.16760834 
        -60.11156361 
        -60.14892676 
   
  
  
       4.23    4.23
       4.30    4.30
   
        -60.12605115 
        -60.07004904 
        -60.10738378 
   
  
  
       4.23    4.24
       4.30    4.31
   
        -60.12926461 
        -60.07326146 
        -60.11059689 
   
  
  
       4.44    4.44
       4.51    4.52
   
        -60.13008986 
        -60.07407666 
        -60.11141880 
   
  
  
       4.50    4.51
       4.58    4.58
   
        -60.13028547 
        -60.07427351 
        -60.11161482 
   
  
  
       4.12    4.12
       4.19    4.20
   
        -60.13056957 
        -60.07455726 
        -60.11189880 
   
  
  
       3.96    3.97
       4.03    4.04
   
        -60.13079903 
        -60.07478633 
        -60.11212813 
   
  
  
       3.36    3.38
       3.44    3.45
   
        -60.13102964 
        -60.07501693 
        -60.11235874 
   
  
  
       2.76    3.02
       2.86    3.13
   
        -60.13118727 
        -60.07517461 
        -60.11251638