vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 02 22 
  22:47:20 
 
 
  No title
       0
  Normal
  Normal (blocked Davidson)
   F  
       2
       2
       1
     102
       2
      -1
        0.00010000
       -0.02000000
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       3375.00000000 
    
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           0.66199313       0.67572173       0.44279548 
   
  
  
           1 
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          41 
  
 
 
  
          1        1        1 
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         0.00000000       0.00000000       0.00000000 
  
  
          0.00000000       0.00000000       0.00000000 
  
  
          1.00000000 
  
 
 
  
   No title
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   normal
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     T  
     T  
   
   
     T  
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      -100
         2
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         0
         2
         1
   
   
         2
     F  
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      0.00000000
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     F  
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     F  
   
   
     F  
     F  
   
   
       102
        -5
         2
        400.00000000
    
      T  
      F  
           0.00000000
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           0.30000000
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           0.40000000
    
   
   
          0.40000000
          1.00000000
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          4
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          1
          5
    
   
   
     F  
     F  
         0
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       80
       80
       80
      160
      160
      160
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        0
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        2
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        0
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        1
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    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  
       118.71000000     12.01100000     14.00100000      1.00000000     16.00000000
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    T  
  
   T  
   F  
       0
   F  
       0
  
   --
        1
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    F  
    F  
    F  
    F  
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    F  
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        0
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    F  
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    F  
    F  
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    F  
         0.00000000      0.00000000      0.00000000
    T  
    F  
    F  
    F  
    T  
        0
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         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
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        0
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      102
        1
        3
        4
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    F  
    F  
    F  
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    F  
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        1
        1
        1
     2800
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       -1
         0.80000001
         1.00000000
  
  
         0.00000000
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    F  
  
 
 
        41 
         5 
  
   ion
   element
   atomtype
   
    Sn   1
    C    2
    C    2
    C    2
    C    2
    C    2
    C    2
    C    2
    C    2
    C    2
    N    3
    N    3
    N    3
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    O    5
   
  
  
   type
   atomspertype
   element
   mass
   valence
   pseudopotential
   
       1Sn    118.71000000     14.00000000  PAW_PBE Sn_d 06Sep2000                
       9C      12.01100000      4.00000000  PAW_PBE C 08Apr2002                   
       3N      14.00100000      5.00000000  PAW_PBE N 08Apr2002                   
      27H       1.00000000      1.00000000  PAW_PBE H 15Jun2001                   
       1O      16.00000000      6.00000000  PAW_PBE O 08Apr2002                   
   
  
 
 
  
   
          15.00000000       0.00000000       0.00000000 
           0.00000000      15.00000000       0.00000000 
           0.00000000       0.00000000      15.00000000 
   
      3375.00000000 
   
           0.06666667       0.00000000       0.00000000 
           0.00000000       0.06666667       0.00000000 
           0.00000000       0.00000000       0.06666667 
   
  
  
          0.47715018       0.61844210       0.45823937 
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          0.64807152       0.55149667       0.66977660 
          0.36410633       0.74502262       0.48517957 
          0.66199313       0.67572173       0.44279548 
  
 
 
  
       3.10    3.11
      12.26   12.26
   
         12.14920346 
       6947.17125774 
     -10584.44729747 
        324.79538545 
       3564.54670454 
      -3612.51371562 
          0.00287704 
       -869.08292090 
       4779.86076685 
        562.48226108 
        562.47938405 
        562.48130207 
   
  
  
       3.10    3.11
       3.11    3.11
   
        -17.01434259 
        -17.03499412 
        -17.02122644 
   
  
  
       3.35    3.36
       3.36    3.36
   
       -217.67217989 
       -217.68766169 
       -217.67734049 
   
  
  
       4.23    4.23
       4.23    4.23
   
       -234.13950064 
       -234.17706038 
       -234.15202055 
   
  
  
       3.99    4.00
       5.00    5.01
   
       -234.68033799 
       -234.71835607 
       -234.69301068 
   
  
  
       2.95    2.96
      14.30   14.30
   
       -212.19150377 
       -212.24976803 
       -212.21092519 
   
  
  
       2.60    2.60
      13.94   13.95
   
       -211.17175741 
       -211.18573694 
       -211.17641725 
   
  
  
       2.71    2.74
      14.20   14.22
   
       -208.75269238 
       -208.76508677 
       -208.75682384 
   
  
  
       2.45    2.48
      13.89   13.93
   
       -208.02542692 
       -208.08030374 
       -208.04371919 
   
  
  
       2.38    2.42
      13.83   13.86
   
       -207.82723005 
       -207.86249152 
       -207.83898388 
   
  
  
       2.41    2.44
      14.00   14.02
   
       -207.81801176 
       -207.87867503 
       -207.83823285 
   
  
  
       2.70    2.72
      14.41   14.42
   
       -207.77191678 
       -207.80897269 
       -207.78426875 
   
  
  
       2.32    2.33
      13.91   13.90
   
       -207.75538367 
       -207.78798311 
       -207.76625015 
   
  
  
       2.23    2.24
      13.80   13.80
   
       -207.73692445 
       -207.77629518 
       -207.75004803 
   
  
  
       2.25    2.26
      13.93   13.93
   
       -207.73926522 
       -207.79464512 
       -207.75772519 
   
  
  
       2.17    2.18
      13.93   13.93
   
       -207.74165577 
       -207.80007406 
       -207.76112853 
   
  
  
       1.74    1.75
      13.44   13.44
   
       -207.74076677 
       -207.79925198 
       -207.76026184 
   
  
  
       1.76    1.77
      13.49   13.49
   
       -207.73872423 
       -207.79858805 
       -207.75867884 
   
  
  
       1.72    1.72
      13.45   13.45
   
       -207.74914921 
       -207.81058222 
       -207.76962688 
   
  
  
       1.70    1.71
      13.43   13.43
   
       -207.75908967 
       -207.82053157 
       -207.77957030 
   
  
  
       1.63    1.64
      13.49   13.49
   
       -207.76295402 
       -207.82420400 
       -207.78337068 
   
  
  
       1.66    1.67
      13.64   13.64
   
       -207.76601015 
       -207.82758937 
       -207.78653656 
   
  
  
       1.73    1.73
      13.49   13.48
   
       -207.76987771 
       -207.83145612 
       -207.79040385 
   
  
  
       1.59    1.60
      13.22   13.22
   
       -207.77179211 
       -207.83017473 
       -207.79125299 
   
  
  
       1.63    1.63
      12.90   12.89
   
       -207.77693818 
       -207.83624233 
       -207.79670623 
   
  
  
       1.61    1.61
      12.72   12.72
   
       -207.77985067 
       -207.83828392 
       -207.79932842 
   
  
  
       1.60    1.60
      12.48   12.48
   
       -207.78124536 
       -207.84097005 
       -207.80115359 
   
  
  
       1.35    1.36
      11.79   11.79
   
       -207.78343604 
       -207.84295903 
       -207.80327703 
   
  
  
       1.35    1.35
      10.73   10.73
   
       -207.78373181 
       -207.84061883 
       -207.80269415 
   
  
  
       1.18    1.19
       9.91    9.91
   
       -207.78486477 
       -207.84170237 
       -207.80381063 
   
  
  
       1.06    1.07
       8.95    8.95
   
       -207.78539949 
       -207.84281980 
       -207.80453960 
   
  
  
       1.07    1.10
       8.44    8.49
   
       -207.78589872 
       -207.84423045 
       -207.80534263 
   
  
  
       0.95    0.96
       7.15    7.16
   
       -207.78617991 
       -207.84514237 
       -207.80583406 
   
  
  
       0.87    0.87
       5.03    5.03
   
       -207.78659905 
       -207.84592058 
       -207.80637289 
   
  
  
       0.84    0.84
       5.20    5.20
   
       -207.78673619 
       -207.84606046 
       -207.80651094 
   
  
  
       0.73    0.73
       4.27    4.27
   
         12.14920346 
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        345.49469697 
       8065.65970949 
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       -207.80653624 
   
  
  
   
    
           15.00000000       0.00000000       0.00000000 
            0.00000000      15.00000000       0.00000000 
            0.00000000       0.00000000      15.00000000 
    
       3375.00000000 
    
            0.06666667       0.00000000       0.00000000 
            0.00000000       0.06666667       0.00000000 
            0.00000000       0.00000000       0.06666667 
    
   
   
           0.47715018       0.61844210       0.45823937 
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           0.50123225       0.73345505       0.29691764 
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           0.57287312       0.65784048       0.69076430 
           0.50677710       0.50467583       0.70947902 
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           0.34882502       0.40836415       0.46573374 
           0.24940270       0.67479709       0.57944370 
           0.36019311       0.64956436       0.61869168 
           0.29849169       0.56665116       0.56047241 
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           0.64807152       0.55149667       0.66977660 
           0.36410633       0.74502262       0.48517957 
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          1.50628169       0.85737429      -0.39730620 
         -0.52585362       0.63214886       0.25991244 
         -0.17445268      -0.91727091      -0.19198208 
          0.44342256       0.83550360       0.37565276 
          0.60806524      -1.10020185      -0.69360155 
          0.23138868      -0.03275672      -0.10479784 
         -1.96286905       0.81250136      -0.10543311 
          3.01856772       1.22442108       0.59982716 
          0.03151798      -0.01495831       0.27738099 
          0.19346101      -0.06778712      -0.22009724 
         -1.21325054      -5.20801020      -1.21575873 
         -3.41291748       1.17299924       0.62565068 
          0.02272309      -2.67412605      -3.31724869 
         -0.26233922       0.87894185       0.13980443 
         -0.09508633       0.73124690      -0.33442708 
          0.10212054      -0.00026626       0.12686890 
          0.63508830       1.35672047      -1.51266198 
         -1.76718220       0.17937729       1.00849126 
          0.63389576      -0.03618583       1.40189732 
         -0.06206039       1.40334264       0.01815797 
          0.46522470       1.45302249       0.34325597 
         -0.00565631      -0.43095662      -0.16955526 
         -0.43570761      -0.36603453       0.38995162 
          0.08656617       0.14526272       0.42714874 
          2.47943752      -0.51890395      -1.42288439 
          0.80950628       0.54372094      -0.37324617 
         -0.35249006       0.45190496       0.06740504 
          0.30355234      -0.00797853       0.66675222 
          0.95495863      -1.61212192       0.06488271 
         -0.03277726       1.40198001      -1.04280296 
         -1.57863170       0.48561386       1.77758540 
         -0.15948867      -0.15730946       0.31480503 
         -0.17522902      -0.01315052       0.34234095 
         -0.11613595       0.09071580       0.11928681 
         -0.09325267       0.06320292      -0.12745036 
         -0.05848937      -0.07209460      -0.16144883 
          0.21000832      -0.20267313      -0.00433031 
         -0.31991797       0.14087728       2.70100694 
          0.03270657      -1.55721484       0.62363998 
         -0.03946994       0.35590191       0.17284328 
          0.07476495      -0.22677910      -1.44951582 
  
  
         -4.44438176       0.26991393       0.55288889 
          0.26991398       0.33889616      -3.83693851 
          0.55288888      -3.83693851       2.05598170 
  
  
      -207.78683344 
      -207.84594184 
      -207.80653624 
  
    404.97  405.22
  
   
    band
    kpoint
    spin
    eigene
    occ
    
     
      
         -25.5058    1.0000 
         -25.4094    1.0000 
         -25.3026    1.0000 
         -25.1639    1.0000 
         -25.1466    1.0000 
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         -10.7161    1.0000 
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          -9.9498    1.0000 
          -9.9292    1.0000 
          -9.7471    1.0000 
          -9.6166    1.0000 
          -9.3604    1.0000 
          -9.2990    1.0000 
          -9.0666    1.0000 
          -8.9813    1.0000 
          -8.9400    1.0000 
          -8.5200    1.0000 
          -8.4046    1.0000 
          -8.2891    1.0000 
          -8.2038    1.0000 
          -8.0770    1.0000 
          -7.7388    1.0000 
          -7.5110    1.0000 
          -7.4648    1.0000 
          -6.4364    1.0000 
          -5.0142    1.0000 
          -4.6604    1.0000 
          -4.0585    1.0000 
          -3.7455    1.0216 
          -3.5827    0.9943 
          -3.1672   -0.0353 
          -0.4633   -0.0000 
          -0.1429   -0.0000 
           0.0042   -0.0000 
           0.0544   -0.0000 
           0.1595   -0.0000 
           0.2615   -0.0000 
           0.3877   -0.0000 
           0.5561   -0.0000 
           0.5985   -0.0000 
           0.6982   -0.0000 
           0.7632   -0.0000 
           0.8663   -0.0000 
           0.9299   -0.0000 
           1.0954   -0.0000 
           1.1219   -0.0000 
           1.1474   -0.0000 
           1.2104   -0.0000 
           1.2777   -0.0000 
           1.3491   -0.0000 
           1.3908   -0.0000 
           1.4372   -0.0000 
           1.4974   -0.0000 
      
     
     
      
         -25.5062    1.0000 
         -25.4119    1.0000 
         -25.3027    1.0000 
         -25.1640    1.0000 
         -25.1471    1.0000 
         -21.5325    1.0000 
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         -19.6448    1.0000 
         -16.9280    1.0000 
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         -11.4473    1.0000 
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          -9.9513    1.0000 
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          -9.7492    1.0000 
          -9.6196    1.0000 
          -9.3611    1.0000 
          -9.2987    1.0000 
          -9.0681    1.0000 
          -8.9824    1.0000 
          -8.9399    1.0000 
          -8.5227    1.0000 
          -8.4044    1.0000 
          -8.2892    1.0000 
          -8.2047    1.0000 
          -8.0780    1.0000 
          -7.7401    1.0000 
          -7.5127    1.0000 
          -7.4692    1.0000 
          -6.4377    1.0000 
          -5.0300    1.0000 
          -4.6631    1.0000 
          -4.0669    1.0000 
          -3.7432    1.0222 
          -3.6384    1.0324 
          -3.1686   -0.0353 
          -0.4631   -0.0000 
          -0.1417   -0.0000 
           0.0060   -0.0000 
           0.0554   -0.0000 
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           0.2610   -0.0000 
           0.3902   -0.0000 
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           0.5966   -0.0000 
           0.6896   -0.0000 
           0.7629   -0.0000 
           0.8690   -0.0000 
           0.9344   -0.0000 
           1.0881   -0.0000 
           1.1123   -0.0000 
           1.1424   -0.0000 
           1.2065   -0.0000 
           1.2678   -0.0000 
           1.3499   -0.0000 
           1.3906   -0.0000 
           1.4325   -0.0000 
           1.5025   -0.0000 
      
     
    
   
  
  
         0.00000000      0.00000000      0.00000000