vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2025 12 01 
  23:31:46 
 
 
  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 
    
   
   
           0.65770922       0.07636885       0.51437631 
           0.22802319       0.64342919       0.17320846 
           0.76673088       0.34457541       0.00834652 
           0.78331565       0.39176396       0.84908975 
           0.50837206       0.24668672       0.38848246 
           0.19153028       0.87814227       0.77154199 
           0.56504479       0.30897849       0.54768483 
           0.43495358       0.47145219       0.10414817 
           0.07931009       0.01426514       0.63929031 
           0.39335172       0.43695797       0.80118117 
           0.37914438       0.78616429       0.67412462 
           0.41001645       0.96907996       0.61950100 
   
  
  
           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 
   
  
  
          0.65770922       0.07636885       0.51437631 
          0.22802319       0.64342919       0.17320846 
          0.76673088       0.34457541       0.00834652 
          0.78331565       0.39176396       0.84908975 
          0.50837206       0.24668672       0.38848246 
          0.19153028       0.87814227       0.77154199 
          0.56504479       0.30897849       0.54768483 
          0.43495358       0.47145219       0.10414817 
          0.07931009       0.01426514       0.63929031 
          0.39335172       0.43695797       0.80118117 
          0.37914438       0.78616429       0.67412462 
          0.41001645       0.96907996       0.61950100 
  
  
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     F  F  F 
     F  F  F 
  
  
         -3.00000000       0.00000000       0.00010000       0.00010000 
  
 
 
  
       3.99    4.06
       4.05    4.13
   
         23.83307581 
       -966.98031351 
      -3510.98245996 
        292.51536337 
       4104.28886790 
      -4141.72589677 
          0.01653858 
       -325.63089185 
       5082.48689363 
        557.82117722 
        557.80463863 
        557.81566435 
   
  
  
       4.90    4.91
       4.90    4.91
   
         64.85895670 
         64.85285099 
         64.85692147 
   
  
  
       4.42    4.44
       4.43    4.44
   
        -35.46578942 
        -35.42224490 
        -35.45127458 
   
  
  
       4.25    4.26
       4.25    4.26
   
        -39.18670176 
        -39.17994427 
        -39.18444926 
   
  
  
       4.84    4.84
       4.86    4.87
   
        -39.89096590 
        -39.84139302 
        -39.87444161 
   
  
  
       4.02    4.02
       4.09    4.10
   
        -57.87302972 
        -57.85664191 
        -57.86756712 
   
  
  
       3.93    3.95
       4.01    4.03
   
        -31.90941282 
        -31.81515476 
        -31.87799346 
   
  
  
       3.97    3.98
       4.04    4.06
   
        -30.14854089 
        -30.11468404 
        -30.13725528 
   
  
  
       4.33    4.34
       4.40    4.41
   
        -28.93527980 
        -28.89011251 
        -28.92022404 
   
  
  
       3.97    3.98
       4.05    4.05
   
        -27.75404303 
        -27.74087730 
        -27.74965445 
   
  
  
       4.09    4.10
       4.17    4.18
   
        -25.68382150 
        -25.65565728 
        -25.67443343 
   
  
  
       4.08    4.08
       4.17    4.17
   
        -25.81050216 
        -25.78530274 
        -25.80210235 
   
  
  
       3.93    3.94
       4.01    4.02
   
        -25.30879159 
        -25.23632748 
        -25.28463688 
   
  
  
       3.95    3.96
       4.04    4.04
   
        -24.98284425 
        -24.99652401 
        -24.98740417 
   
  
  
       4.25    4.25
       4.32    4.33
   
        -26.20885100 
        -26.27144053 
        -26.22971418 
   
  
  
       3.71    3.72
       3.79    3.79
   
        -24.48958978 
        -24.56558593 
        -24.51492183 
   
  
  
       4.49    4.49
       4.57    4.57
   
        -23.98576547 
        -23.95979441 
        -23.97710845 
   
  
  
       4.37    4.38
       4.45    4.46
   
        -23.60383940 
        -23.45544664 
        -23.55437515 
   
  
  
       4.50    4.50
       4.58    4.59
   
        -29.65205578 
        -29.54172002 
        -29.61527720 
   
  
  
       3.91    3.91
       3.98    3.99
   
        -28.74992702 
        -28.60537451 
        -28.70174285 
   
  
  
       4.28    4.29
       4.36    4.37
   
        -28.53656873 
        -28.40830013 
        -28.49381253 
   
  
  
       4.12    4.13
       4.19    4.21
   
        -26.67224963 
        -26.58678245 
        -26.64376057