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 
    
   
   
           0.38303540       0.30835403       0.44448475 
           0.50153986       0.39695828       0.51422790 
           0.63308247       0.38750067       0.42285161 
           0.72871319       0.44932773       0.49735075 
           0.68366151       0.26832297       0.38062930 
           0.60770636       0.46399904       0.31376914 
           0.40500763       0.17784177       0.40803997 
           0.28149978       0.30897634       0.53410647 
           0.53728949       0.30743147       0.62416162 
           0.34526492       0.37662269       0.33427566 
           0.47697347       0.49315008       0.53036474 
           0.51090577       0.83995138       0.45681982 
   
  
  
           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 
   
  
  
          0.38303540       0.30835403       0.44448475 
          0.50153986       0.39695828       0.51422790 
          0.63308247       0.38750067       0.42285161 
          0.72871319       0.44932773       0.49735075 
          0.68366151       0.26832297       0.38062930 
          0.60770636       0.46399904       0.31376914 
          0.40500763       0.17784177       0.40803997 
          0.28149978       0.30897634       0.53410647 
          0.53728949       0.30743147       0.62416162 
          0.34526492       0.37662269       0.33427566 
          0.47697347       0.49315008       0.53036474 
          0.51090577       0.83995138       0.45681982 
  
 
 
  
       4.73    4.79
       4.83    4.89
   
         15.25316852 
       2496.94927145 
      -6825.12254441 
        303.83947223 
       4104.28886790 
      -4141.72589677 
         -0.00379554 
       -406.63167017 
       5082.48689363 
        629.33376684 
        629.33756238 
        629.33503202 
   
  
  
       5.28    5.29
       5.28    5.29
   
         84.50438045 
         84.51368388 
         84.50748159 
   
  
  
       4.37    4.38
       4.37    4.38
   
        -57.59344443 
        -57.53742103 
        -57.57476997 
   
  
  
       4.34    4.35
       4.34    4.35
   
        -61.50001920 
        -61.44360266 
        -61.48121369 
   
  
  
       4.75    4.76
       4.78    4.80
   
        -61.57728701 
        -61.52087045 
        -61.55848149 
   
  
  
       4.33    4.33
       4.46    4.46
   
        -58.66186692 
        -58.60545146 
        -58.64306177 
   
  
  
       4.43    4.44
       4.56    4.56
   
        -58.48637025 
        -58.42995474 
        -58.46756508 
   
  
  
       4.22    4.23
       4.33    4.35
   
        -58.47547646 
        -58.41906082 
        -58.45667124 
   
  
  
       4.44    4.46
       4.57    4.59
   
        -58.47622758 
        -58.41981191 
        -58.45742236 
   
  
  
       4.26    4.28
       4.39    4.40
   
        -58.47619882 
        -58.41978310 
        -58.45739358 
   
  
  
       4.21    4.22
       4.34    4.35
   
        -58.47684851 
        -58.42043275 
        -58.45804325 
   
  
  
       4.13    4.14
       4.26    4.27
   
        -58.47828164 
        -58.42186584 
        -58.45947637 
   
  
  
       4.08    4.09
       4.20    4.21
   
        -58.47956775 
        -58.42315192 
        -58.46076248 
   
  
  
       4.20    4.21
       4.33    4.35
   
        -58.48019823 
        -58.42378238 
        -58.46139295 
   
  
  
       3.65    3.66
       3.78    3.80
   
        -58.48068066 
        -58.42426480 
        -58.46187537 
   
  
  
       3.35    3.36
       3.49    3.50
   
        -58.48084858 
        -58.42443272 
        -58.46204329 
   
  
  
       3.19    3.20
       3.32    3.33
   
        -58.48098122 
        -58.42456536 
        -58.46217593 
   
  
  
       3.11    3.15
       3.24    3.27
   
        -58.48100715 
        -58.42459129 
        -58.46220186 
   
  
  
       2.52    2.61
       2.65    2.74
   
        -58.48103387 
        -58.42461802 
        -58.46222859