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 
    
   
   
           0.38486403       0.42766008       0.54166918 
           0.43911988       0.57110120       0.43186220 
           0.57490107       0.53954712       0.34583816 
           0.34511101       0.60387697       0.30788018 
           0.26255888       0.47018989       0.60196429 
           0.37099347       0.28384829       0.45507365 
           0.61143927       0.68008337       0.26153247 
           0.67059827       0.50373463       0.46056073 
           0.56930138       0.41300042       0.23502479 
           0.46808950       0.39887590       0.67246997 
           0.44977156       0.68416575       0.50778399 
           0.50164183       0.94199075       0.49618209 
   
  
  
           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 
   
  
  
          0.38486403       0.42766008       0.54166918 
          0.43911988       0.57110120       0.43186220 
          0.57490107       0.53954712       0.34583816 
          0.34511101       0.60387697       0.30788018 
          0.26255888       0.47018989       0.60196429 
          0.37099347       0.28384829       0.45507365 
          0.61143927       0.68008337       0.26153247 
          0.67059827       0.50373463       0.46056073 
          0.56930138       0.41300042       0.23502479 
          0.46808950       0.39887590       0.67246997 
          0.44977156       0.68416575       0.50778399 
          0.50164183       0.94199075       0.49618209 
  
 
 
  
       3.26    3.37
       3.32    3.43
   
         23.83307581 
       1653.51600268 
      -6012.73138806 
        304.48851715 
       4104.28886790 
      -4141.72589677 
          0.00367261 
       -414.10761778 
       5082.48689363 
        600.05212716 
        600.04845456 
        600.05090296 
   
  
  
       5.08    5.08
       5.08    5.09
   
         35.04423897 
         35.08209295 
         35.05685696 
   
  
  
       4.26    4.26
       4.26    4.26
   
        -60.83601648 
        -60.78117071 
        -60.81773456 
   
  
  
       4.24    4.24
       4.24    4.24
   
        -62.35874209 
        -62.30349447 
        -62.34032622 
   
  
  
       4.64    4.64
       4.66    4.67
   
        -62.39720500 
        -62.34191650 
        -62.37877550 
   
  
  
       4.23    4.23
       4.30    4.31
   
        -59.59010235 
        -59.53516448 
        -59.57178973 
   
  
  
       4.50    4.51
       4.58    4.58
   
        -59.40859610 
        -59.35373285 
        -59.39030835 
   
  
  
       4.23    4.24
       4.30    4.31
   
        -59.40251434 
        -59.34769442 
        -59.38424104 
   
  
  
       4.23    4.23
       4.30    4.30
   
        -59.40389441 
        -59.34907836 
        -59.38562240 
   
  
  
       4.51    4.51
       4.58    4.59
   
        -59.40418607 
        -59.34935835 
        -59.38591016 
   
  
  
       4.17    4.18
       4.24    4.25
   
        -59.40471965 
        -59.34989332 
        -59.38644420 
   
  
  
       4.19    4.20
       4.26    4.27
   
        -59.40528583 
        -59.35045881 
        -59.38701015 
   
  
  
       3.82    3.83
       3.90    3.90
   
        -59.40577614 
        -59.35094906 
        -59.38750045 
   
  
  
       3.89    3.90
       3.96    3.97
   
        -59.40602055 
        -59.35119382 
        -59.38774497 
   
  
  
       3.25    3.26
       3.33    3.34
   
        -59.40610881 
        -59.35128188 
        -59.38783316