vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 09 08 
  12:57:55 
 
 
  No title
       0
  Normal
  Normal (blocked Davidson)
   F  
       2
       2
       1
      60
       2
      -1
        0.00001000
       -0.02000000
       0
       2
       1
      400.00000000
        0.77000000      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 
    
   
   
           0.51017340       0.56008763       0.52684921 
           0.50944707       0.66588785       0.52797154 
           0.51996234       0.24800626       0.52633596 
           0.40639124       0.52133936       0.52707049 
           0.56303781       0.52146572       0.61625403 
           0.56197087       0.52334961       0.43596118 
   
  
  
           1 
           2 
           3 
           4 
           5 
           6 
  
 
 
  
          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
       12
       -1
       -1
         9.00000000
        0
        0
        0
        0
         0.00000000
   
         1
          0.20000000
          0.50000000
     T  
     T  
   
   
     T  
         -0.00050000     -0.00050000
      -100
         2
     F  
   
   
         0
         2
         1
   
   
         2
     F  
          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
           0.00000021
           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      0.32000000
      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
  
  
        3
        4
       -1
    T  
    F  
    F  
    F  
    F  
    F  
  
  
        3
       -1
    F  
        12.01100000      1.00000000
         0.00000000      0.00000000
         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
       100.00000000
         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  
  
 
 
         6 
         2 
  
   ion
   element
   atomtype
   
    C    1
    H    2
    H    2
    H    2
    H    2
    H    2
   
  
  
   type
   atomspertype
   element
   mass
   valence
   pseudopotential
   
       1C      12.01100000      4.00000000  PAW_PBE C 08Apr2002                   
       5H       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 
   
  
  
          0.51017340       0.56008763       0.52684921 
          0.50944707       0.66588785       0.52797154 
          0.51996234       0.24800626       0.52633596 
          0.40639124       0.52133936       0.52707049 
          0.56303781       0.52146572       0.61625403 
          0.56197087       0.52334961       0.43596118 
  
 
 
  
       2.28    2.46
       2.74    2.92
   
          0.29445765 
        133.81123524 
       -257.20220665 
         25.84194308 
        117.36544724 
       -117.96785702 
         -0.00108860 
        -88.99433134 
        209.52038720 
         22.66798680 
         22.66907540 
         22.66834966 
   
  
  
       2.95    3.03
       2.95    3.03
   
        -16.26781474 
        -16.26854854 
        -16.26805934 
   
  
  
       3.36    3.44
       3.36    3.44
   
        -20.87905771 
        -20.88488747 
        -20.88100096 
   
  
  
       3.50    3.59
       3.50    3.59
   
        -21.01919266 
        -21.02499064 
        -21.02112532 
   
  
  
       3.38    3.54
       3.48    3.65
   
        -21.02021039 
        -21.02600837 
        -21.02214305 
   
  
  
       2.30    2.50
       2.88    3.08
   
         -7.58348511 
         -7.58928318 
         -7.58541780 
   
  
  
       2.74    2.86
       3.23    3.35
   
        -19.18600369 
        -19.19180180 
        -19.18793639 
   
  
  
       2.61    2.72
       3.11    3.21
   
        -22.00901684 
        -22.01481500 
        -22.01094956 
   
  
  
       2.35    2.57
       2.88    3.11
   
        -24.76429236 
        -24.77009058 
        -24.76622510 
   
  
  
       2.13    2.25
       2.67    2.80
   
        -24.99632475 
        -25.00212299 
        -24.99825749 
   
  
  
       2.28    2.47
       2.90    3.10
   
        -25.04074786 
        -25.04654610 
        -25.04268060 
   
  
  
       2.35    2.49
       2.98    3.12
   
        -25.07143184 
        -25.07723001 
        -25.07336457 
   
  
  
       2.64    2.78
       3.24    3.38
   
        -25.08096222 
        -25.08676040 
        -25.08289495 
   
  
  
       2.14    2.30
       2.65    2.81
   
        -25.08815589 
        -25.09395409 
        -25.09008862 
   
  
  
       2.75    2.87
       3.22    3.35
   
        -25.09136152 
        -25.09715974 
        -25.09329426 
   
  
  
       2.31    2.44
       2.78    2.92
   
        -25.09818035 
        -25.10397858 
        -25.10011309 
   
  
  
       2.70    2.80
       3.18    3.29
   
        -25.10199735 
        -25.10779559 
        -25.10393010