vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2025 01 15 
  20:50:56 
 
 
  No title
       0
  Normal
  Normal (blocked Davidson)
   F  
       1
       2
       1
     200
       2
      -1
        0.00001000
       -0.02000000
       0
       2
       1
      400.00000000
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  Auto
       1
        0.20000000
       1
   F  
   F  
       1
 
 
  
   
    
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         269 
         270 
         271 
         272 
         273 
         274 
         275 
         276 
         277 
         278 
         279 
         280 
         281 
         282 
         283 
         284 
         285 
         286 
         287 
         288 
         289 
         290 
         291 
         292 
         293 
         294 
         295 
         296 
         297 
         298 
         299 
         300 
         301 
         302 
         303 
         304 
         305 
         306 
         307 
         308 
         309 
         310 
         311 
         312 
         313 
         314 
         315 
         316 
         317 
         318 
         319 
         320 
         321 
  
 
 
  
          1        1        1 
         0.00000000       0.00000000       0.00000000 
         1.00000000       0.00000000       0.00000000 
         0.00000000       1.00000000       0.00000000 
         0.00000000       0.00000000       1.00000000 
         0.00000000       0.00000000       0.00000000 
  
  
          0.00000000       0.00000000       0.00000000 
  
  
          1.00000000 
  
 
 
  
   No title
    F  
  
  
   normal
       400.00000000
       644.87300000
         0.00001000
       38
       10
      753
       -1
       -1
      1184.00000000
        0
        0
        0
        0
         0.00000000
   
         1
          0.20000000
          0.50000000
     T  
     T  
   
   
     T  
         -0.00050000     -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      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      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      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  
   
   
       200
        -5
         2
        400.00000000
    
      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
   
  
  
       80
      140
       80
      160
      280
      160
    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
         1.11000000      0.73000000      0.32000000      0.77000000
      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  
        28.08500000     16.00000000      1.00000000     12.01100000
         0.00000000      0.00000000      0.00000000      0.00000000
         1.00000000      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
    F  
    F  
    F  
        0
        0
    F  
         0.00000000
         0.00000000
        0
  
  
    F  
        -0.84910000
         0.12340000
         1.00000000
         0.00000000
  
  
        0
        13.50293501
         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
      200
        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  
  
 
 
       321 
         4 
  
   ion
   element
   atomtype
   
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   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
    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
    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
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    O    2
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    C    4
    C    4
    C    4
    C    4
    C    4
    C    4
    C    4
    C    4
   
  
  
   type
   atomspertype
   element
   mass
   valence
   pseudopotential
   
     193Si     28.08500000      4.00000000  PAW_PBE Si 05Jan2001                  
      52O      16.00000000      6.00000000  PAW_PBE O 08Apr2002                   
      68H       1.00000000      1.00000000  PAW_PBE H 15Jun2001                   
       8C      12.01100000      4.00000000  PAW_PBE C 08Apr2002                   
   
  
 
 
  
   
          15.46772000       0.00000000       0.00000000 
           0.00000000      28.46772000       0.00000000 
           0.00000000       0.00000000      16.40601000 
   
      7224.07022841 
   
           0.06465077       0.00000000       0.00000000 
           0.00000000       0.03512751       0.00000000 
           0.00000000       0.00000000       0.06095327 
   
  
  
          0.99486883       0.36819530       0.26995792 
          0.99486883       0.43611311       0.18662458 
          0.11986883       0.36819530       0.35329125 
          0.11986883       0.43611311       0.10329125 
          0.99615047       0.64075201       0.26714506 
          0.99668308       0.16254448       0.18716082 
          0.12111366       0.64224274       0.35021125 
          0.12168133       0.16255048       0.10261007 
          0.99494574       0.23208592       0.26900097 
          0.99436691       0.57156307       0.18630930 
          0.11996861       0.23216303       0.35393090 
          0.11956607       0.57190024       0.10196088 
          0.99486883       0.50403091       0.26995792 
          0.99486883       0.30027750       0.18662458 
          0.11986883       0.50403091       0.35329125 
          0.11986883       0.30027750       0.10329125 
          0.99486883       0.36819530       0.60329125 
          0.99486883       0.43611311       0.51995792 
          0.11986883       0.36819530       0.68662458 
          0.11986883       0.43611311       0.43662458 
          0.99877298       0.64161787       0.60264079 
          0.99695412       0.16262341       0.52039369 
          0.12265501       0.64105397       0.68830494 
          0.12193505       0.16266358       0.43584804 
          0.99490551       0.23208076       0.60238646 
          0.49478783       0.57335829       0.52124852 
          0.11988963       0.23210608       0.68737725 
          0.12041399       0.57323812       0.43503836 
          0.99486883       0.50403091       0.60329125 
          0.99486883       0.30027750       0.51995792 
          0.11986883       0.50403091       0.68662458 
          0.11986883       0.30027750       0.43662458 
          0.99486883       0.36819530       0.93662458 
          0.99486883       0.43611311       0.85329125 
          0.11986883       0.36819530       0.01995792 
          0.11986883       0.43611311       0.76995792 
          0.99673615       0.64138011       0.93586950 
          0.99690071       0.16264131       0.85378403 
          0.12149222       0.64147979       0.02051998 
          0.12193016       0.16261581       0.76925124 
          0.99493278       0.23209073       0.93582660 
          0.49605359       0.57186588       0.85506447 
          0.11991138       0.23210232       0.02078975 
          0.12027044       0.57179091       0.76978552 
          0.99486883       0.50403091       0.93662458 
          0.99486883       0.30027750       0.85329125 
          0.11986883       0.50403091       0.01995792 
          0.11986883       0.30027750       0.76995792 
          0.24486883       0.36819530       0.26995792 
          0.24486883       0.43611311       0.18662458 
          0.36986883       0.36819530       0.35329125 
          0.36986883       0.43611311       0.10329125 
          0.24612409       0.64062756       0.26638721 
          0.24668057       0.16254905       0.18715587 
          0.36962478       0.64159676       0.35210639 
          0.37167935       0.16255358       0.10260731 
          0.24495925       0.23208544       0.26900619 
          0.24478954       0.57144604       0.18588078 
          0.36997100       0.23216233       0.35393432 
          0.37020406       0.57193902       0.10220792 
          0.24486883       0.50403091       0.26995792 
          0.24486883       0.30027750       0.18662458 
          0.36986883       0.50403091       0.35329125 
          0.36986883       0.30027750       0.10329125 
          0.24486883       0.36819530       0.60329125 
          0.24486883       0.43611311       0.51995792 
          0.36986883       0.36819530       0.68662458 
          0.36986883       0.43611311       0.43662458 
          0.24921256       0.64161372       0.60632126 
          0.24696158       0.16265653       0.52040731 
          0.37270220       0.63972626       0.69169821 
          0.37192762       0.16267081       0.43584003 
          0.24491355       0.23209793       0.60244264 
          0.24517025       0.57307408       0.52090555 
          0.36993509       0.23209617       0.68738399 
          0.37006220       0.57257342       0.43556888 
          0.24486883       0.50403091       0.60329125 
          0.24486883       0.30027750       0.51995792 
          0.36986883       0.50403091       0.68662458 
          0.36986883       0.30027750       0.43662458 
          0.24486883       0.36819530       0.93662458 
          0.24486883       0.43611311       0.85329125 
          0.36986883       0.36819530       0.01995792 
          0.36986883       0.43611311       0.76995792 
          0.24677476       0.64137839       0.93672244 
          0.24690758       0.16265977       0.85379689 
          0.37218059       0.64150087       0.02067772 
          0.37192927       0.16259786       0.76923806 
          0.24493203       0.23209829       0.93587564 
          0.24501322       0.57193923       0.85478699 
          0.36993419       0.23210418       0.02078903 
          0.37089020       0.57082089       0.77172465 
          0.24486883       0.50403091       0.93662458 
          0.24486883       0.30027750       0.85329125 
          0.36986883       0.50403091       0.01995792 
          0.36986883       0.30027750       0.76995792 
          0.49486883       0.36819530       0.26995792 
          0.49486883       0.43611311       0.18662458 
          0.61986883       0.36819530       0.35329125 
          0.61986883       0.43611311       0.10329125 
          0.49601181       0.64177512       0.26933203 
          0.49668423       0.16255563       0.18713650 
          0.62214275       0.64110528       0.35220740 
          0.62168789       0.16255200       0.10260377 
          0.49494574       0.23208592       0.26900097 
          0.49492498       0.57217162       0.18753113 
          0.61996861       0.23216303       0.35393090 
          0.61994088       0.57199218       0.10261532 
          0.49486883       0.50403091       0.26995792 
          0.49486883       0.30027750       0.18662458 
          0.61986883       0.50403091       0.35329125 
          0.61986883       0.30027750       0.10329125 
          0.49486883       0.36819530       0.60329125 
          0.49486883       0.43611311       0.51995792 
          0.61986883       0.36819530       0.68662458 
          0.61986883       0.43611311       0.43662458 
          0.49620022       0.64253832       0.60610152 
          0.49696130       0.16264019       0.52037639 
          0.62286993       0.64122427       0.68807855 
          0.62195161       0.16268088       0.43585496 
          0.49490551       0.23208076       0.60238646 
          0.99564105       0.57223207       0.52047164 
          0.61988963       0.23210608       0.68737725 
          0.61968506       0.57235574       0.43600496 
          0.49486883       0.50403091       0.60329125 
          0.49486883       0.30027750       0.51995792 
          0.61986883       0.50403091       0.68662458 
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          0.24294087       0.83427524       0.47938643 
  
  
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         -3.00000000       0.00000000       0.00010000       0.00010000 
  
 
 
  
      33.68   33.68
      39.01   39.01
   
        517.66239122 
      38463.52497769 
     -80282.21222281 
        -76.66083621 
      36041.75636066 
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       5903.46048318 
       5903.46371969 
       5903.46156202 
   
  
  
      39.27   39.27
      39.28   39.28
   
       -885.72893753 
       -885.75715310 
       -885.73834272 
   
  
  
      38.35   38.35
      38.36   38.36
   
      -1808.89241227 
      -1808.80864960 
      -1808.86449138 
   
  
  
      38.80   38.81
      38.81   38.81
   
      -1851.06991858 
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      41.70   41.70
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      -1852.50292441 
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      39.60   39.60
      43.90   43.89
   
      -1738.93106189 
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      37.27   37.26
      40.81   40.80
   
      -1740.79523376 
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      38.60   38.60
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      -1732.20141808 
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      36.97   36.97
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      38.85   38.84
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      -1731.75862330 
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      38.20   38.20
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      38.35   38.35
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      35.03   35.02
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      -1731.36353513 
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      36.94   36.94
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      -1731.36654499 
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      34.45   34.45
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      35.35   35.34
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      40.96   40.94
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      35.57   35.58
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      35.63   35.63
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      34.92   34.92
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      35.54   35.53
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      38.02   38.02
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      -1731.34616881 
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      35.57   35.57
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          0.03575666       0.12720522       0.02911161 
         -0.00377007       0.01185811       0.02820877 
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         -0.00351693      -0.01516151       0.00197480 
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         -0.02280768      -0.01363784       0.00378338 
         -0.00766049       0.00095126      -0.00375827 
         -0.01895164       0.05015555       0.02166496 
         -0.00428267       0.00938730       0.00998573 
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         -0.01515222      -0.06131229       0.10906183 
         -0.01303249       0.00843015       0.00046368 
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         -0.00484644       0.00635471      -0.02899534 
         -0.00078289      -0.05367247      -0.01522573 
          0.00723679       0.01242144       0.01811024 
         -0.00256834      -0.01665151       0.01116424 
         -0.00875252       0.01457890      -0.00063258 
         -0.00270786      -0.01249921      -0.01501848 
         -0.00388191       0.00583390       0.00205709 
          0.00585267       0.01562237      -0.00165526 
          0.00035165      -0.00048906       0.00626007 
         -0.00811407      -0.01171658      -0.01116353 
         -0.00501647       0.01907485       0.00325720 
          0.00283894       0.01009837       0.00015157 
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         -0.00036575      -0.00204041      -0.00461213 
          0.01208025      -0.01308208      -0.00773021 
         -0.00190332      -0.07283809       0.03888162 
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         -0.00303425      -0.00076896       0.01996002 
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         -0.01808555       0.04819569       0.04924481 
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         -0.03350905      -0.55079159       0.52510164 
         -0.00717717       0.00494089      -0.00944829 
          0.15789884      -0.16226897       0.06713265 
         -0.00367713       0.01407576       0.00951704 
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         -0.01385555       0.00823789       0.00215303 
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         -0.00333450       0.01023957      -0.03793584 
          0.03180590      -0.10064820       0.01112700 
          0.01194668       0.01026047       0.01082559 
         -0.00646501      -0.01286847       0.01188264 
          0.00585951       0.00855786       0.00238173 
          0.00005840      -0.01340131      -0.01612066 
         -0.01360779      -0.00268429      -0.02716191 
         -0.00510298       0.00252600      -0.01876342 
          0.00018739      -0.00152237       0.00541066 
          0.00091675      -0.01518492      -0.01122076 
         -0.00666211       0.02035356       0.00175796 
          0.00139970       0.00973614      -0.00478601 
          0.02295663      -0.03260101       0.02743746 
          0.00021225      -0.00039640      -0.00560623 
         -0.11787122       0.03812782      -0.00532952 
         -0.05006097      -0.06518672       0.09377257 
         -0.00477066       0.00440246      -0.01361256 
          0.02709333      -0.06029156      -0.06760899 
         -0.00804597       0.00168031       0.01078479 
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         -0.03172054      -0.00886690       0.01816115 
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         -0.10665084      -0.13814604       0.00090406 
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         -0.00304349       0.00399408      -0.00332576 
          0.02697680       0.00631963       0.01079883 
         -0.00002903       0.00109721       0.01760144 
         -0.00332530      -0.00315936      -0.00107812 
         -0.00341405      -0.02691885       0.01432103 
          0.00906162       0.01202326      -0.02669950 
          0.00546891       0.04524876       0.01941935 
         -0.00362654       0.01181352       0.02924879 
          0.00380729      -0.01708982      -0.00767674 
         -0.00585224       0.01654967       0.02736478 
         -0.00450543      -0.01540043       0.00694591 
          0.00622234       0.01233435      -0.00499796 
         -0.18300464       1.39619412      -1.01727336 
         -0.00783584       0.00886949      -0.00157843 
         -0.03403814      -0.13820895       0.02877365 
         -0.00389179       0.01080667       0.00980729 
          0.00543247       0.00802348      -0.00174844 
         -0.00180543      -0.00266078      -0.00100206 
         -0.01314086       0.00582833       0.00206437 
         -0.04312996      -0.01377901      -0.00835229 
          0.01635361       0.13905501      -0.11021658 
         -0.00456589       0.00643951      -0.01993891 
         -0.02003394      -0.06316649      -0.01126944 
          0.00659024       0.01006419       0.01440266 
         -0.00560248      -0.01410482       0.01158114 
          0.00520208       0.01612085      -0.00356554 
         -0.00029462      -0.01367367      -0.01600483 
          0.00239886       0.00784098      -0.01177638 
         -0.00527236      -0.01980926       0.00711517 
          0.00069675       0.00270373       0.00481967 
          0.00342427      -0.01683499      -0.00911018 
         -0.00448435       0.02186986       0.00139295 
          0.00228324       0.01125833       0.00031948 
         -0.01389799       0.00423607       0.00316094 
         -0.00018104      -0.00172374      -0.00630286 
          0.05975338       0.01536910       0.00225253 
          0.03118815      -0.10872018       0.10577720 
         -0.00534200       0.00730158      -0.01575121 
         -0.01264656      -0.05556737      -0.03504990 
         -0.00648570       0.00527230       0.01421648 
          0.00190501      -0.01316518      -0.00525812 
          0.01179490       0.00351341       0.00766154 
          0.00524054      -0.01496568       0.00245488 
          0.00512934       0.01464382       0.00828372 
         -0.00798320       0.04095139       0.01785406 
          0.00547995       0.00809907      -0.00475595 
          0.01710721       0.00719061       0.02472036 
          0.00287793       0.00798545       0.00056632 
         -0.00522741       0.00192377      -0.00538455 
         -0.00229767      -0.00576798       0.02591934 
         -0.00030541      -0.00192215       0.01858835 
         -0.00076934       0.01158349       0.00881159 
          0.00237828      -0.05453945       0.00910878 
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          0.01338136      -0.01875668      -0.00976113 
         -0.00249340       0.01306818       0.02986915 
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         -0.00461303      -0.01433687      -0.00114278 
          0.00511852       0.01022451      -0.00770191 
         -0.03661231       0.00296938       0.01012087 
         -0.00725012       0.00364691      -0.00206073 
         -0.00334296       0.01353373      -0.00296983 
         -0.00391945       0.00795194       0.00831792 
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         -0.01614410       0.00919868      -0.00075158 
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         -0.00262134      -0.02024616       0.00777764 
         -0.00322575       0.00730715      -0.02631596 
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         -0.00093996      -0.01269232       0.01023183 
         -0.01170012       0.01044035       0.00530296 
         -0.00024576      -0.01404803      -0.01612369 
         -0.00149274       0.00677701       0.00334303 
          0.00965124      -0.00671194       0.00101405 
         -0.00092049       0.00104964       0.00407435 
         -0.01623117      -0.00485551      -0.00775944 
         -0.00521574       0.01679461       0.00022396 
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         -0.01725181      -0.03271575       0.02700961 
          0.00046779      -0.00058770      -0.00537091 
         -0.01431007      -0.00264068      -0.00038704 
          0.02769158      -0.03813394       0.03117251 
         -0.00685982       0.00374188      -0.01278281 
         -0.01827821      -0.10209850      -0.09992141 
         -0.00516522       0.00370070       0.01877774 
         13.23505145       1.39027934      -2.62224995 
          0.00161539      -0.00450730       0.00560752 
         -0.00042546      -0.00084266       0.00039574 
          0.00025338      -0.00098131      -0.00385617 
          0.00044567      -0.00563787      -0.00260465 
         -0.00105865      -0.00162606      -0.00126921 
          0.00107654       0.00041024      -0.00153140 
          0.00156379      -0.00794055       0.00700570 
          0.00025189      -0.00342763      -0.00040590 
          0.00151414      -0.00473539      -0.00262816 
         -0.00167951      -0.01485879      -0.00413985 
         -0.00051888      -0.00175013      -0.00113432 
          0.00089082      -0.00671813      -0.00327303 
          0.00476312       0.00941826       0.00464885 
          0.05972347       0.10585288       0.07982403 
          0.02831048       0.01054781      -0.01509576 
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          0.00208476      -0.01007249      -0.00004853 
         -0.00187775       0.01175799       0.00824131 
         -0.01239576       0.03518557      -0.00985996 
         -0.31975463      -0.05816619      -0.45784789 
         -0.15798488       1.82759050      -0.01013195 
         -0.05203113       0.07558726       0.00287794 
         -0.00013962      -0.00770928       0.00666851 
          0.00210716       0.01724247       0.00667191 
          0.00026377      -0.00841726       0.00660228 
         -0.00110675      -0.00439138      -0.00120498 
         -0.00054398      -0.01450271      -0.00123223 
         -0.00173347      -0.01070601      -0.00442011 
         -0.00083697      -0.00637378      -0.00011225 
         -0.00074035      -0.00888728      -0.00182206 
          0.00000469      -0.00505482       0.00471184 
         -0.00117129      -0.00180063      -0.00050911 
         -0.00080491      -0.00441217      -0.00244487 
         -0.00070689      -0.00600679      -0.00323694 
         -0.00149530      -0.00542128      -0.00027062 
         -0.00022431      -0.00201937      -0.00081694 
          0.00682991       0.02749761      -0.02364644 
          3.14055065      -1.26961006      -1.81862735 
         -0.22247680      -0.44055019       0.76801454 
          0.01743552       0.12606961       0.02497846 
         -0.00025204       0.04094755       0.00068878 
          0.00322799       0.01749990       0.00509404 
          0.00366965       0.00185072      -0.00273126 
          0.02170242      -0.01076243      -0.01828128 
          0.03785642      -0.00480690      -0.02100366 
          0.00387348      -0.00557093       0.00322597 
         -0.00222321       0.00612654       0.00390479 
          0.00352342       0.00955397       0.00656135 
        -15.71191234      -2.82257642      -8.33781345 
         -5.91815790     -12.58596748       1.18035263 
        -28.25781983      -1.62772342       8.46081860 
         -0.82163709       1.97228211       2.09668328 
          0.00235625       0.00474394      -0.00097471 
          0.00063738       0.00090713      -0.00133582 
          0.00129325       0.00452556       0.00129772 
          0.00046309       0.00266665      -0.00107111 
          0.00065841       0.00198517      -0.00033263 
          0.00131481      -0.00003905       0.00032958 
          0.00164462       0.00391174      -0.00095580 
         -0.00034545       0.00182794      -0.00192700 
         -0.00102503       0.00059851       0.00270002 
          0.00101206       0.00474285      -0.00127748 
          0.00104873       0.00069825      -0.00080886 
          0.00094027       0.00228741       0.00070184 
          0.00462967      -0.00407662       0.00002507 
         -0.05568585      -0.01273820      -0.00533011 
         -0.00308892       0.01715570       0.00075327 
         -0.00874018      -0.01004844      -0.01302134 
          0.00513976      -0.00316066      -0.00485917 
          0.00221619      -0.00254263      -0.00514980 
          0.26032716      -0.20024395      -0.20939727 
         -0.00459049       0.00412348       0.01344842 
          0.00361555       0.01267760       0.00638723 
          0.00389098      -0.00627056      -0.00177748 
         -1.45638064      -0.70696810       0.00235917 
         -0.24158745       0.35485420      -0.67733187 
          0.00164927       0.00240902      -0.00023482 
          0.00066750       0.00296691      -0.00098526 
          0.00080828       0.00014580       0.00124059 
          0.00221857       0.00448583       0.00012475 
          0.00143339       0.00112029      -0.00072636 
          0.00150340       0.00302539      -0.00075899 
          0.00255825       0.00337890      -0.00057723 
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          0.00148616       0.00212735       0.00046900 
          0.00171323       0.00251188       0.00000990 
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          0.00176256       0.00093165      -0.00040879 
         -0.00034725       0.00104804      -0.00331711 
         -3.37697653       1.36468051       1.90278820 
         -0.00919454       0.00169572      -0.00506281 
         -0.00258639      -0.03276486      -0.00141477 
          0.00139834       0.00535867      -0.00159189 
         -0.00180541      -0.00517026       0.00143000 
          0.00300558      -0.00172303      -0.00301377 
         -0.01517152       0.00670336       0.01570950 
          1.36345900      -2.20523369      -0.55560651 
          0.00209788      -0.00160390      -0.00445413 
         -0.00162764      -0.00134847      -0.00951523 
          0.00539561      -0.00110935      -0.00293732 
         22.58908782      -5.30529924      -2.21331649 
         -1.46386196      16.60936419      -8.08385749 
          6.92383771       7.91855264       4.51732734 
          2.55056234     -16.77186879      10.52382587 
        -24.81499491       8.01772682       4.05859586 
          7.53236365      -2.36745991       4.32280877 
          2.14086725      -8.94867406     -10.64702391 
         13.46747523       0.63910313      -3.87067595 
         -1.24062181       9.12680631      10.32062403 
         -4.73224911       2.45151807      -5.25247228 
          0.08277955      -0.43492350       0.98512917 
         -0.63027118       0.12023010       1.23048245 
          1.25144857       0.55616862       0.23303537 
          2.62515575       0.64069786      -1.51381403 
         -1.03732925      -2.40933599      -0.67854293 
         -0.09358292       0.16531034      -0.37945547 
          0.90543179       2.19556444       0.73334006 
         -2.35320614      -0.54147750       1.35371750 
         -0.16722397      -1.39748568      -0.16936776 
          0.02514940      -0.00813686       0.06672802 
         -8.54954005       1.52375904      17.71136782 
         13.58425703       0.69465941     -18.10657875 
         14.01551842      -1.71846958      -0.10247106 
         -3.29827139       2.69823462      -2.38082808 
          0.92963407       0.09847157      -0.48750713 
         -0.08749268      -0.03611849       0.02403861 
          0.31084023      -1.34599642      -0.25324454 
         -1.77666688       2.07966053      -1.60242094 
  
  
         25.93486518       0.05294613       1.53881855 
          0.05294630       8.59400628       0.96967574 
          1.53881827       0.96967585      -3.36078325 
  
  
     -1731.35773023 
     -1731.39946011 
     -1731.37164019 
  
   1342.61 1342.52
  
   
    band
    kpoint
    spin
    eigene
    occ
    
     
      
         -23.6723    1.0000 
         -23.1471    1.0000 
         -22.6353    1.0000 
         -19.6620    1.0000 
         -19.4656    1.0000 
         -19.4597    1.0000 
         -19.4378    1.0000 
         -19.4331    1.0000 
         -19.4328    1.0000 
         -19.4051    1.0000 
         -19.3207    1.0000 
         -19.3204    1.0000 
         -19.2997    1.0000 
         -19.2993    1.0000 
         -19.2951    1.0000 
         -19.2949    1.0000 
         -19.2904    1.0000 
         -19.2865    1.0000 
         -19.2618    1.0000 
         -19.2593    1.0000 
         -19.1450    1.0000 
         -18.9789    1.0000 
         -18.9785    1.0000 
         -18.9771    1.0000 
         -18.9764    1.0000 
         -18.9727    1.0000 
         -18.9711    1.0000 
         -18.9493    1.0000 
         -18.9360    1.0000 
         -18.9345    1.0000 
         -18.9138    1.0000 
         -18.8617    1.0000 
         -18.6785    1.0000 
         -18.6783    1.0000 
         -18.6752    1.0000 
         -18.6749    1.0000 
         -18.6502    1.0000 
         -18.6499    1.0000 
         -18.6287    1.0000 
         -18.6168    1.0000 
         -18.6145    1.0000 
         -18.6041    1.0000 
         -18.5901    1.0000 
         -18.5651    1.0000 
         -18.5615    1.0000 
         -18.5225    1.0000 
         -18.4979    1.0000 
         -18.4741    1.0000 
         -18.4321    1.0000 
         -18.3188    1.0000 
         -17.1954    1.0000 
         -15.8341    1.0000 
         -14.8264    1.0000 
         -14.4874    1.0000 
         -14.1276    1.0000 
         -12.2419    1.0000 
         -11.5789    1.0000 
         -11.1184    1.0000 
         -10.4826    1.0000 
         -10.1760    1.0000 
          -9.8363    1.0000 
          -9.7082    1.0000 
          -9.7050    1.0000 
          -9.6503    1.0000 
          -9.6459    1.0000 
          -9.3943    1.0000 
          -9.3908    1.0000 
          -9.3698    1.0000 
          -9.3263    1.0000 
          -9.3148    1.0000 
          -9.2136    1.0000 
          -9.2101    1.0000 
          -9.2066    1.0000 
          -9.2004    1.0000 
          -9.1743    1.0000 
          -9.0423    1.0000 
          -9.0002    1.0000 
          -8.9805    1.0000 
          -8.9337    1.0000 
          -8.9268    1.0000 
          -8.9133    1.0000 
          -8.9098    1.0000 
          -8.8962    1.0000 
          -8.8626    1.0000 
          -8.8535    1.0000 
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          -8.5556    1.0000 
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          -8.5342    1.0000 
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          -8.4397    1.0000 
          -8.4146    1.0000 
          -8.3985    1.0000 
          -8.3451    1.0000 
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