vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2023 05 13 
  22:57:44 
 
 
  No title
       0
  Normal
  Normal (blocked Davidson)
   F  
       1
       2
       1
     240
       2
      -1
        0.00001000
       -0.02000000
       0
       2
       1
      400.00000000
        1.41000000      0.73000000      0.32000000
  Auto
       1
        0.20000000
       1
   F  
   F  
       1
 
 
  
   
    
            4.73727000       0.00000000       0.00000000 
            0.00000000       4.73727000       0.00000000 
            0.00000000       0.00000000      18.37276000 
    
        412.31646513 
    
            0.21109204       0.00000000       0.00000000 
            0.00000000       0.21109204       0.00000000 
            0.00000000       0.00000000       0.05442840 
    
   
   
           0.05431664       0.17929369       0.35265259 
           0.98936950       0.85330097       0.28870716 
           0.10103253       0.88049157       0.07519280 
           0.36188998       0.55127218       0.84437759 
           0.05345390       0.67410541       0.06594824 
           0.74455080       0.20671080       0.69864414 
           0.37104523       0.40167396       0.87543900 
           0.88436235       0.10978634       0.63957210 
           0.85697347       0.53763506       0.59951829 
           0.81148842       0.41233259       0.19564946 
           0.62559028       0.44853837       0.48927095 
           0.50755096       0.46166459       0.70146096 
           0.33910320       0.09469009       0.14204429 
           0.72537151       0.00200676       0.91515268 
           0.15221261       0.06133936       0.12194430 
           0.45616443       0.15605204       0.81131094 
           0.24558534       0.88727196       0.56248367 
           0.04662533       0.33645153       0.41088484 
           0.17506124       0.27311398       0.66500054 
           0.13493728       0.43254533       0.11773883 
           0.15573695       0.01264785       0.41765659 
           0.17564386       0.68339354       0.99340639 
   
  
  
           1 
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           3 
           4 
           5 
           6 
           7 
           8 
           9 
          10 
          11 
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          13 
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          19 
          20 
          21 
          22 
  
 
 
  
          3        3        1 
         0.00000000       0.00000000       0.00000000 
         0.33333333       0.00000000       0.00000000 
         0.00000000       0.33333333       0.00000000 
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         0.00000000       0.00000000       0.00000000 
  
  
          0.00000000       0.00000000       0.00000000 
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         -0.33333333       0.33333333       0.00000000 
  
  
          0.11111111 
          0.22222222 
          0.22222222 
          0.22222222 
          0.22222222 
  
 
 
  
   No title
    F  
  
  
   normal
       400.00000000
       605.39200000
         0.00001000
       38
       10
      102
       -1
       -1
       170.00000000
        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      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  
   
   
       240
        -5
         2
        400.00000000
    
      T  
      F  
           0.00000000
           0.00000002
           0.30000000
          4
           0.40000000
    
   
   
          0.40000000
          1.00000000
          0.10000000
          1.60000000
          1.00000000
    
          4
      F  
        -45
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          1
          1
          5
    
   
   
     F  
     F  
         0
          1.00000000
       -100.00000000   -100.00000000   -100.00000000
          0.00000000
   
  
  
       24
       24
       90
       48
       48
      180
    F  
  
  
        0
       -1
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        2
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         0.00010000
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        1
        1
      256
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        2
         0.00001000
  
  
        0
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      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
  
  
        6
        4
       -1
    T  
    F  
    F  
    F  
    F  
    F  
  
  
        3
       -1
    F  
       118.71000000     16.00000000      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
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    F  
        0
        0
    F  
         0.00000000
         0.00000000
        0
  
  
    F  
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         0.12340000
         1.00000000
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        0
        11.24499450
         1.00000000
  
  
    F  
    F  
    F  
    F  
        0
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    F  
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    T  
    F  
    F  
    F  
    T  
        0
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    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
      240
        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  
  
 
 
        22 
         3 
  
   ion
   element
   atomtype
   
    Sn   1
    Sn   1
    Sn   1
    Sn   1
    Sn   1
    Sn   1
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    H    3
    H    3
   
  
  
   type
   atomspertype
   element
   mass
   valence
   pseudopotential
   
       6Sn    118.71000000     14.00000000  PAW_PBE Sn_d 06Sep2000                
      14O      16.00000000      6.00000000  PAW_PBE O 08Apr2002                   
       2H       1.00000000      1.00000000  PAW_PBE H 15Jun2001                   
   
  
 
 
  
   
           4.73727000       0.00000000       0.00000000 
           0.00000000       4.73727000       0.00000000 
           0.00000000       0.00000000      18.37276000 
   
       412.31646513 
   
           0.21109204       0.00000000       0.00000000 
           0.00000000       0.21109204       0.00000000 
           0.00000000       0.00000000       0.05442840 
   
  
  
          0.05431664       0.17929369       0.35265259 
          0.98936950       0.85330097       0.28870716 
          0.10103253       0.88049157       0.07519280 
          0.36188998       0.55127218       0.84437759 
          0.05345390       0.67410541       0.06594824 
          0.74455080       0.20671080       0.69864414 
          0.37104523       0.40167396       0.87543900 
          0.88436235       0.10978634       0.63957210 
          0.85697347       0.53763506       0.59951829 
          0.81148842       0.41233259       0.19564946 
          0.62559028       0.44853837       0.48927095 
          0.50755096       0.46166459       0.70146096 
          0.33910320       0.09469009       0.14204429 
          0.72537151       0.00200676       0.91515268 
          0.15221261       0.06133936       0.12194430 
          0.45616443       0.15605204       0.81131094 
          0.24558534       0.88727196       0.56248367 
          0.04662533       0.33645153       0.41088484 
          0.17506124       0.27311398       0.66500054 
          0.13493728       0.43254533       0.11773883 
          0.15573695       0.01264785       0.41765659 
          0.17564386       0.68339354       0.99340639 
  
 
 
  
       3.15    3.48
       3.20    3.53
   
        333.57168661 
      -5633.63300537 
      -9798.17029254 
        754.06947263 
      14269.25296877 
     -14517.83836857 
         -0.02364572 
       -275.80181337 
      17435.26881048 
       2566.69581292 
       2566.71945864 
       2566.70369483 
   
  
  
       2.77    3.10
       2.78    3.10
   
        599.84828387 
        599.86936133 
        599.85530969 
   
  
  
       2.73    2.92
       2.73    2.92
   
        178.95754915 
        178.95768058 
        178.95759296 
   
  
  
       2.82    3.01
       2.82    3.01
   
        139.51463902 
        139.54595679 
        139.52507828 
   
  
  
       3.04    3.30
       3.07    3.35
   
        137.44514817 
        137.47653239 
        137.45560958 
   
  
  
       3.64    3.92
       3.71    4.00
   
        163.92002675 
        163.96285164 
        163.93430171 
   
  
  
       3.72    3.98
       3.78    4.06
   
       -338.57285355 
       -338.57763929 
       -338.57444880 
   
  
  
       3.68    3.85
       3.75    3.94
   
         99.63714270 
         99.65274778 
         99.64234439 
   
  
  
       3.18    3.35
       3.25    3.43
   
        151.04951897 
        151.04905317 
        151.04936370 
   
  
  
       3.53    3.85
       3.59    3.93
   
        161.77445773 
        161.79717191 
        161.78202912 
   
  
  
       3.47    3.67
       3.54    3.76
   
        154.08732519 
        154.07188629 
        154.08217889 
   
  
  
       2.99    3.26
       3.05    3.34
   
        189.81679164 
        189.83775902 
        189.82378076 
   
  
  
       3.45    3.60
       3.52    3.68
   
        191.48183376 
        191.56417314 
        191.50928022 
   
  
  
       3.19    3.40
       3.25    3.47
   
        193.90730970 
        193.91488775 
        193.90983572 
   
  
  
       3.17    3.37
       3.24    3.45
   
        194.29683263 
        194.26174593 
        194.28513706 
   
  
  
       3.19    3.40
       3.26    3.48
   
        191.88197042 
        191.91914234 
        191.89436106 
   
  
  
       2.96    3.20
       3.04    3.30
   
        194.13422859 
        194.19594431 
        194.15480050 
   
  
  
       3.30    3.51
       3.37    3.59
   
        193.78611934 
        193.85166477 
        193.80796782 
   
  
  
       3.44    3.61
       3.50    3.69
   
        195.18131305 
        195.27067688 
        195.21110099 
   
  
  
       3.24    3.39
       3.30    3.47
   
        195.64052969 
        195.59693463 
        195.62599800 
   
  
  
       3.18    3.38
       3.25    3.51
   
        196.43670331 
        196.43922377 
        196.43754346 
   
  
  
       3.34    3.60
       3.41    3.68
   
        197.53002994 
        197.53487567 
        197.53164518 
   
  
  
       2.63    2.85
       2.70    2.95
   
        197.60256681 
        197.61618732 
        197.60710698 
   
  
  
       3.31    3.58
       3.38    3.65
   
        198.02531958 
        198.03111726 
        198.02725214