vasp 
  6.1.1  
  19Jun20 (build Jun 25 2020 02:42:34) complex                          parallel 
  Lin64 
  2021 09 27 
  14:17:34 
 
 
   No title
       0
   Normal
   Normal (blocked Davidson)
   F  
       1
       2
       1
      60
       2
      -1
        0.00001000
       -0.02000000
       0
       2
       1
      242.67600000
        1.30000000      1.41000000
   Auto
       1
        0.20000000
       1
   F  
   F  
       4
   Normal (blocked Davidson)
      60
       1
        0.00001000
       1
 
 
  
   
           9.39666000       0.00000000       0.00000000 
           0.00000000       9.39666000       0.00000000 
           0.00000000       0.00000000      28.79330000 
   
      2542.36832031 
   
           0.10642079       0.00000000       0.00000000 
           0.00000000       0.10642079       0.00000000 
           0.00000000       0.00000000       0.03473030 
   
  
  
          0.08285486       0.08380541       0.20063150 
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          0.08285486       0.08380541       0.41820092 
          0.24952153       0.25047208       0.58137516 
          0.22538710       0.95199311       0.60011485 
          0.24952153       0.25047208       0.25502604 
          0.08285486       0.08380541       0.30941809 
          0.24952153       0.25047208       0.69015799 
          0.08285486       0.08380541       0.63576658 
          0.24952153       0.25047208       0.36380950 
          0.08285486       0.41713875       0.20063150 
          0.41993972       0.56526382       0.84107721 
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          0.24952153       0.58380541       0.47259233 
          0.08285486       0.41713875       0.41820092 
          0.24952153       0.58380541       0.58137516 
          0.09384588       0.27793961       0.70725633 
          0.24952153       0.58380541       0.25502604 
          0.08285486       0.41713875       0.30941809 
          0.24952153       0.58380541       0.69015799 
          0.08285486       0.41713875       0.63576658 
          0.24952153       0.58380541       0.36380950 
          0.08285486       0.75047208       0.20063150 
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          0.58285486       0.58380541       0.58137516 
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          0.83830170       0.35686924       0.71120776 
          0.58285486       0.91713875       0.25502604 
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          0.58285486       0.91713875       0.69015799 
          0.41618820       0.75047208       0.63576658 
          0.58285486       0.91713875       0.36380950 
          0.74952153       0.08380541       0.20063150 
          0.90640766       0.24255514       0.05147917 
          0.74952153       0.08380541       0.52698375 
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          0.91618820       0.25047208       0.58137516 
          0.89066071       0.07195984       0.70719570 
          0.91618820       0.25047208       0.25502604 
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          0.91618820       0.25047208       0.69015799 
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          0.91618820       0.25047208       0.36380950 
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          0.91618820       0.58380541       0.47259233 
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          0.91618820       0.58380541       0.58137516 
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          0.91618820       0.58380541       0.25502604 
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          0.67647988       0.59243648       0.72147162 
          0.91618820       0.91713875       0.25502604 
          0.74952153       0.75047208       0.30941809 
          0.91618820       0.91713875       0.69015799 
          0.74952153       0.75047208       0.63576658 
          0.91618820       0.91713875       0.36380950 
          0.60770112       0.55987572       0.71712569 
  
 
 
          1 
          2 
          3 
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        100 
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        102 
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        105 
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        107 
        108 
        109 
 
 
  
          2        2        1 
         0.00000000       0.00000000       0.00000000 
         0.50000000       0.00000000       0.00000000 
         0.00000000       0.50000000       0.00000000 
         0.00000000       0.00000000       1.00000000 
         0.00000000       0.00000000       0.00000000 
  
  
          0.00000000       0.00000000       0.00000000 
          0.50000000       0.00000000       0.00000000 
          0.00000000       0.50000000       0.00000000 
          0.50000000       0.50000000       0.00000000 
  
  
          0.25000000 
          0.25000000 
          0.25000000 
          0.25000000 
  
 
 
  
   No title
    F  
  
  
   normal
       242.67600000
       446.01400000
         0.00001000
       38
       10
      916
       -1
       -1
      1526.00000000
        0
        0
        0
        0
         0.00000000
   
         1
          0.20000000
          0.50000000
     T  
     T  
   
   
     T  
         -0.00050000     -0.00050000
      -100
         2
     F  
   
   
         0
         2
         1
   
   
         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      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      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      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      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  
   
   
        60
        -5
         2
        242.67600000
    
      T  
      F  
           0.00000000
           0.00000000
           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
   
  
  
       36
       36
      112
       72
       72
      224
    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
         1.30000000      1.41000000
      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  
        95.94000000    118.71000000
         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
        13.99468800
         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
         1.00000000
  
  
         0.00000000
         0.00000000      0.00000000      0.00000000
         0.00000000
         0.00000000
         0.00000000
  
  
    F  
  
 
 
       109 
         2 
  
   ion
   element
   atomtype
   
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Mo   1
    Sn   2
   
  
  
   type
   atomspertype
   element
   mass
   valence
   pseudopotential
   
     108Mo     95.94000000     14.00000000  PAW_PBE Mo_sv 02Feb2006               
       1Sn    118.71000000     14.00000000  PAW_PBE Sn_d 06Sep2000                
   
  
 
 
  
   
           9.39666000       0.00000000       0.00000000 
           0.00000000       9.39666000       0.00000000 
           0.00000000       0.00000000      28.79330000 
   
      2542.36832031 
   
           0.10642079       0.00000000       0.00000000 
           0.00000000       0.10642079       0.00000000 
           0.00000000       0.00000000       0.03473030 
   
  
  
          0.08285486       0.08380541       0.20063150 
          0.89686413       0.02756933       0.93929606 
          0.08285486       0.08380541       0.52698375 
          0.24952153       0.25047208       0.47259233 
          0.08285486       0.08380541       0.41820092 
          0.24952153       0.25047208       0.58137516 
          0.22538710       0.95199311       0.60011485 
          0.24952153       0.25047208       0.25502604 
          0.08285486       0.08380541       0.30941809 
          0.24952153       0.25047208       0.69015799 
          0.08285486       0.08380541       0.63576658 
          0.24952153       0.25047208       0.36380950 
          0.08285486       0.41713875       0.20063150 
          0.41993972       0.56526382       0.84107721 
          0.08285486       0.41713875       0.52698375 
          0.24952153       0.58380541       0.47259233 
          0.08285486       0.41713875       0.41820092 
          0.24952153       0.58380541       0.58137516 
          0.09384588       0.27793961       0.70725633 
          0.24952153       0.58380541       0.25502604 
          0.08285486       0.41713875       0.30941809 
          0.24952153       0.58380541       0.69015799 
          0.08285486       0.41713875       0.63576658 
          0.24952153       0.58380541       0.36380950 
          0.08285486       0.75047208       0.20063150 
          0.13953885       0.01904697       0.20839873 
          0.08285486       0.75047208       0.52698375 
          0.24952153       0.91713875       0.47259233 
          0.08285486       0.75047208       0.41820092 
          0.24952153       0.91713875       0.58137516 
          0.48433186       0.08538777       0.67207866 
          0.24952153       0.91713875       0.25502604 
          0.08285486       0.75047208       0.30941809 
          0.24952153       0.91713875       0.69015799 
          0.08285486       0.75047208       0.63576658 
          0.24952153       0.91713875       0.36380950 
          0.41618820       0.08380541       0.20063150 
          0.15445776       0.16417532       0.86022992 
          0.41618820       0.08380541       0.52698375 
          0.58285486       0.25047208       0.47259233 
          0.41618820       0.08380541       0.41820092 
          0.58285486       0.25047208       0.58137516 
          0.08362589       0.67700544       0.66976356 
          0.58285486       0.25047208       0.25502604 
          0.41618820       0.08380541       0.30941809 
          0.58285486       0.25047208       0.69015799 
          0.41618820       0.08380541       0.63576658 
          0.58285486       0.25047208       0.36380950 
          0.41618820       0.41713875       0.20063150 
          0.24063898       0.94152454       0.59446774 
          0.41618820       0.41713875       0.52698375 
          0.58285486       0.58380541       0.47259233 
          0.41618820       0.41713875       0.41820092 
          0.58285486       0.58380541       0.58137516 
          0.57733235       0.49294344       0.72110680 
          0.58285486       0.58380541       0.25502604 
          0.41618820       0.41713875       0.30941809 
          0.58285486       0.58380541       0.69015799 
          0.41618820       0.41713875       0.63576658 
          0.58285486       0.58380541       0.36380950 
          0.41618820       0.75047208       0.20063150 
          0.60159892       0.74156350       0.84021160 
          0.41618820       0.75047208       0.52698375 
          0.58285486       0.91713875       0.47259233 
          0.41618820       0.75047208       0.41820092 
          0.58285486       0.91713875       0.58137516 
          0.83830170       0.35686924       0.71120776 
          0.58285486       0.91713875       0.25502604 
          0.41618820       0.75047208       0.30941809 
          0.58285486       0.91713875       0.69015799 
          0.41618820       0.75047208       0.63576658 
          0.58285486       0.91713875       0.36380950 
          0.74952153       0.08380541       0.20063150 
          0.90640766       0.24255514       0.05147917 
          0.74952153       0.08380541       0.52698375 
          0.91618820       0.25047208       0.47259233 
          0.74952153       0.08380541       0.41820092 
          0.91618820       0.25047208       0.58137516 
          0.89066071       0.07195984       0.70719570 
          0.91618820       0.25047208       0.25502604 
          0.74952153       0.08380541       0.30941809 
          0.91618820       0.25047208       0.69015799 
          0.74952153       0.08380541       0.63576658 
          0.91618820       0.25047208       0.36380950 
          0.74952153       0.41713875       0.20063150 
          0.99333648       0.00940154       0.86152484 
          0.74952153       0.41713875       0.52698375 
          0.91618820       0.58380541       0.47259233 
          0.74952153       0.41713875       0.41820092 
          0.91618820       0.58380541       0.58137516 
          0.78097240       0.38436410       0.85281721 
          0.91618820       0.58380541       0.25502604 
          0.74952153       0.41713875       0.30941809 
          0.91618820       0.58380541       0.69015799 
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