vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2025 11 29 
  14:13:06 
 
 
  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 
    
   
   
           0.38448205       0.42532914       0.54122357 
           0.43779507       0.57100677       0.43377339 
           0.57344372       0.54029235       0.34706060 
           0.34360768       0.60494968       0.31060238 
           0.26300542       0.46732770       0.60431244 
           0.36960680       0.28273648       0.45202779 
           0.60925934       0.68096850       0.26264377 
           0.66995322       0.50612975       0.46145976 
           0.56831946       0.41304089       0.23625070 
           0.46852814       0.39416300       0.67084100 
           0.44864663       0.68194498       0.51292755 
           0.51174262       0.95018511       0.48471875 
   
  
  
           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 
   
  
  
          0.38448205       0.42532914       0.54122357 
          0.43779507       0.57100677       0.43377339 
          0.57344372       0.54029235       0.34706060 
          0.34360768       0.60494968       0.31060238 
          0.26300542       0.46732770       0.60431244 
          0.36960680       0.28273648       0.45202779 
          0.60925934       0.68096850       0.26264377 
          0.66995322       0.50612975       0.46145976 
          0.56831946       0.41304089       0.23625070 
          0.46852814       0.39416300       0.67084100 
          0.44864663       0.68194498       0.51292755 
          0.51174262       0.95018511       0.48471875 
  
 
 
  
       1.76    1.98
       1.82    2.04
   
         23.83307581 
       1651.84056747 
      -6011.56578787 
        304.44755635 
       4104.28886790 
      -4141.72589677 
          0.02108865 
       -404.11127373 
       5082.48689363 
        609.51509144 
        609.49400279 
        609.50806189 
   
  
  
       4.27    4.30
       4.27    4.30
   
         37.55678210 
         37.58755691 
         37.56704037 
   
  
  
       4.29    4.30
       4.29    4.30
   
        -60.78080595 
        -60.72547323 
        -60.76236171 
   
  
  
       4.22    4.24
       4.22    4.24
   
        -62.35634576 
        -62.30091282 
        -62.33786811 
   
  
  
       4.65    4.66
       4.67    4.68
   
        -62.39583860 
        -62.34037723 
        -62.37735148 
   
  
  
       4.29    4.29
       4.36    4.36
   
        -59.59021129 
        -59.53503626 
        -59.57181961 
   
  
  
       4.49    4.50
       4.56    4.57
   
        -59.40757010 
        -59.35244072 
        -59.38919364 
   
  
  
       4.25    4.25
       4.32    4.32
   
        -59.40108407 
        -59.34598150 
        -59.38271655 
   
  
  
       4.25    4.25
       4.32    4.32
   
        -59.40236575 
        -59.34726589 
        -59.38399913 
   
  
  
       4.50    4.51
       4.57    4.58
   
        -59.40266575 
        -59.34755653 
        -59.38429601 
   
  
  
       4.20    4.20
       4.27    4.27
   
        -59.40322166 
        -59.34811312 
        -59.38485215 
   
  
  
       4.23    4.24
       4.30    4.31
   
        -59.40382003 
        -59.34871076 
        -59.38545027 
   
  
  
       3.72    3.72
       3.79    3.80
   
        -59.40433778 
        -59.34922824 
        -59.38596793 
   
  
  
       3.92    3.93
       3.99    4.00
   
        -59.40459784 
        -59.34948844 
        -59.38622804 
   
  
  
       3.22    3.23
       3.29    3.30
   
        -59.40468885 
        -59.34957927 
        -59.38631899 
   
  
  
       3.23    3.23
       3.31    3.31
   
        -59.40474738 
        -59.34963775 
        -59.38637750