vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2023 05 13 
  23:11:24 
 
 
  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 
    
   
   
           0.55877745       0.57598225       0.31477102 
           0.89454322       0.82997348       0.04974499 
           0.91438638       0.04136207       0.36076943 
           0.38398918       0.69596772       0.32865190 
           0.29490382       0.89915417       0.93000384 
           0.95180007       0.88671100       0.19009261 
           0.41937977       0.34659559       0.94236759 
           0.44795038       0.13324188       0.33548824 
           0.36932244       0.28504965       0.65907576 
           0.80556527       0.89100889       0.72380781 
           0.75863730       0.15475516       0.09400436 
           0.47541298       0.33565428       0.37459202 
           0.98386869       0.23374158       0.15385334 
           0.42039902       0.64227610       0.20961073 
           0.92339641       0.67072601       0.41554540 
           0.66664756       0.05471633       0.50949467 
           0.73494001       0.73098872       0.12202735 
           0.30096806       0.19825587       0.12399615 
           0.62890980       0.25359725       0.30548020 
           0.99764561       0.03839501       0.64926583 
           0.15798450       0.02491782       0.09891885 
           0.70141485       0.21888392       0.93221893 
   
  
  
           1 
           2 
           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  
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          1
          1
          5
    
   
   
     F  
     F  
         0
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       -100.00000000   -100.00000000   -100.00000000
          0.00000000
   
  
  
       24
       24
       90
       48
       48
      180
    F  
  
  
        0
       -1
        0
        2
         0.00000000
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        0
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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
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        1
        1
        1
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        0
        0
    F  
         0.00000000
         0.00000000
        0
  
  
    F  
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         1.00000000
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        0
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         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
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        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 
   
  
  
          0.55877745       0.57598225       0.31477102 
          0.89454322       0.82997348       0.04974499 
          0.91438638       0.04136207       0.36076943 
          0.38398918       0.69596772       0.32865190 
          0.29490382       0.89915417       0.93000384 
          0.95180007       0.88671100       0.19009261 
          0.41937977       0.34659559       0.94236759 
          0.44795038       0.13324188       0.33548824 
          0.36932244       0.28504965       0.65907576 
          0.80556527       0.89100889       0.72380781 
          0.75863730       0.15475516       0.09400436 
          0.47541298       0.33565428       0.37459202 
          0.98386869       0.23374158       0.15385334 
          0.42039902       0.64227610       0.20961073 
          0.92339641       0.67072601       0.41554540 
          0.66664756       0.05471633       0.50949467 
          0.73494001       0.73098872       0.12202735 
          0.30096806       0.19825587       0.12399615 
          0.62890980       0.25359725       0.30548020 
          0.99764561       0.03839501       0.64926583 
          0.15798450       0.02491782       0.09891885 
          0.70141485       0.21888392       0.93221893 
  
 
 
  
       3.17    3.36
       3.23    3.42
   
        333.57168661 
       9428.90493959 
     -25229.42933252 
        748.13166081 
      14269.25296877 
     -14517.83836857 
         -0.00682387 
        -27.60835733 
      17435.26881048 
       2440.24718397 
       2440.25400783 
       2440.24945859 
   
  
  
       2.67    2.82
       2.67    2.82
   
        472.77258774 
        472.76081033 
        472.76866194 
   
  
  
       2.82    3.01
       2.82    3.01
   
         54.92069862 
         54.93856298 
         54.92665341 
   
  
  
       2.94    3.34
       2.95    3.34
   
         17.00476145 
         17.06478899 
         17.02477063 
   
  
  
       3.23    3.44
       3.26    3.51
   
         15.40794708 
         15.46924084 
         15.42837833 
   
  
  
       3.54    3.68
       3.61    3.76
   
        -35.82761771 
        -35.83327736 
        -35.82950426 
   
  
  
       3.56    3.81
       3.63    3.89
   
       -219.24902884 
       -219.26111293 
       -219.25305687 
   
  
  
       3.14    3.28
       3.21    3.39
   
       -126.10024790 
       -126.10257869 
       -126.10102483 
   
  
  
       3.41    3.76
       3.48    3.85
   
        -46.63548737 
        -46.64197796 
        -46.63765090 
   
  
  
       3.14    3.55
       3.21    3.64
   
         -2.61609999 
         -2.59120139 
         -2.60780046 
   
  
  
       3.37    3.61
       3.43    3.69
   
         22.75874413 
         22.76859115 
         22.76202647 
   
  
  
       3.09    3.29
       3.16    3.40
   
         28.33179082 
         28.29991037 
         28.32116400 
   
  
  
       2.84    3.29
       2.92    3.38
   
         31.33219950 
         31.35356749 
         31.33932217 
   
  
  
       3.06    3.22
       3.12    3.30
   
         37.90298436 
         37.90563246 
         37.90386706 
   
  
  
       2.76    2.93
       2.83    3.02
   
         37.98982296 
         38.01028347 
         37.99664313 
   
  
  
       3.28    3.51
       3.35    3.58
   
         41.76396260 
         41.75200399 
         41.75997640 
   
  
  
       2.71    2.89
       2.77    3.00
   
         41.53015771 
         41.54039824 
         41.53357122 
   
  
  
       2.96    3.16
       3.03    3.24
   
         42.08727414 
         42.06595542 
         42.08016790 
   
  
  
       3.23    3.40
       3.30    3.48
   
         42.43988698 
         42.44758798 
         42.44245398