vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2025 11 29 
  14:13:26 
 
 
  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 
    
   
   
           0.38548479       0.42969671       0.53156469 
           0.44307841       0.52150104       0.38576793 
           0.58416017       0.51703000       0.32509954 
           0.35450447       0.57232426       0.27139932 
           0.26262382       0.49086703       0.56968995 
           0.36964120       0.26198722       0.49689846 
           0.61974174       0.66703922       0.25757266 
           0.67056642       0.47904611       0.44947534 
           0.59996005       0.39983019       0.20097399 
           0.46462797       0.44070199       0.66857465 
           0.47884528       0.84696921       0.56920263 
           0.41515583       0.89108136       0.59162252 
   
  
  
           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 
   
  
  
          0.38548479       0.42969671       0.53156469 
          0.44307841       0.52150104       0.38576793 
          0.58416017       0.51703000       0.32509954 
          0.35450447       0.57232426       0.27139932 
          0.26262382       0.49086703       0.56968995 
          0.36964120       0.26198722       0.49689846 
          0.61974174       0.66703922       0.25757266 
          0.67056642       0.47904611       0.44947534 
          0.59996005       0.39983019       0.20097399 
          0.46462797       0.44070199       0.66857465 
          0.47884528       0.84696921       0.56920263 
          0.41515583       0.89108136       0.59162252 
  
 
 
  
       4.43    4.47
       4.49    4.53
   
         23.83307581 
       1489.32054438 
      -5849.70579510 
        304.10208737 
       4104.28886790 
      -4141.72589677 
         -0.00623568 
       -382.20392897 
       5082.48689363 
        630.38961258 
        630.39584826 
        630.39169114 
   
  
  
       5.26    5.26
       5.26    5.26
   
         42.80842393 
         42.82141830 
         42.81275538 
   
  
  
       4.44    4.44
       4.44    4.45
   
        -61.57622464 
        -61.54208820 
        -61.56484583 
   
  
  
       4.39    4.39
       4.39    4.39
   
        -63.30827163 
        -63.25203962 
        -63.28952763 
   
  
  
       4.62    4.63
       4.65    4.65
   
        -63.35079175 
        -63.29447576 
        -63.33201975 
   
  
  
       4.34    4.34
       4.42    4.42
   
        -60.49521219 
        -60.43894569 
        -60.47645669 
   
  
  
       4.54    4.54
       4.61    4.61
   
        -60.17734042 
        -60.12111070 
        -60.15859718 
   
  
  
       4.35    4.36
       4.43    4.43
   
        -60.13367457 
        -60.07747134 
        -60.11494016 
   
  
  
       4.29    4.29
       4.37    4.37
   
        -60.13664114 
        -60.08043796 
        -60.11790674 
   
  
  
       4.64    4.64
       4.71    4.71
   
        -60.13751104 
        -60.08130239 
        -60.11877482 
   
  
  
       4.63    4.64
       4.71    4.71
   
        -60.13777405 
        -60.08156611 
        -60.11903807 
   
  
  
       4.28    4.29
       4.36    4.36
   
        -60.13813063 
        -60.08192245 
        -60.11939457 
   
  
  
       4.06    4.07
       4.14    4.15
   
        -60.13838993 
        -60.08218157 
        -60.11965381 
   
  
  
       3.69    3.69
       3.76    3.77
   
        -60.13864373 
        -60.08243537 
        -60.11990761 
   
  
  
       3.49    3.50
       3.57    3.58
   
        -60.13881265 
        -60.08260432 
        -60.12007654 
   
  
  
       3.12    3.30
       3.22    3.39
   
        -60.13890410 
        -60.08269573 
        -60.12016798