vasp 
  6.1.1  
  19Jun20 (build Jun 25 2020 02:42:34) complex                          parallel 
  Lin64 
  2022 01 24 
  14:43:17 
 
 
   No title
       0
   Normal
   Normal (blocked Davidson)
   F  
       1
       2
       1
      60
       2
      -1
        0.00001000
       -0.02000000
       0
       2
       1
      400.00000000
        1.11000000      0.73000000      0.72000000
   Auto
       1
        0.20000000
       1
   F  
   F  
       2
   Normal (blocked Davidson)
      60
       1
        0.00001000
       1
 
 
  
   
          12.54222000       0.00000000       0.00000000 
           0.00000000       8.36148000       0.00000000 
           0.00000000       0.00000000      33.39015000 
   
      3501.67583981 
   
           0.07973070       0.00000000       0.00000000 
           0.00000000       0.11959605       0.00000000 
           0.00000000       0.00000000       0.02994895 
   
  
  
          0.99963673       0.25014674       0.64889273 
          0.16665322       0.99984173       0.35230068 
          0.00005395       0.24971917       0.56306228 
          0.16666244       0.99987357       0.43807315 
          0.99993243       0.24983168       0.48120232 
          0.16675894       0.99995776       0.51992065 
          0.99995575       0.24986498       0.40126403 
          0.16645421       0.00048042       0.59982925 
          0.99997493       0.24983902       0.32460450 
          0.16586925       0.00104972       0.67644772 
          0.00024181       0.74954366       0.64887997 
          0.16665217       0.49981505       0.35230222 
          0.99980044       0.74996921       0.56305485 
          0.16666053       0.49982986       0.43807120 
          0.99992698       0.74986672       0.48120026 
          0.16665370       0.49991944       0.51990996 
          0.99996616       0.74987037       0.40126333 
          0.16649665       0.49999861       0.59982935 
          0.99997595       0.74984179       0.32460317 
          0.16643970       0.50010124       0.67644471 
          0.33332112       0.24999163       0.64914842 
          0.49996577       0.99985331       0.35232196 
          0.33347896       0.25053520       0.56327964 
          0.49994740       0.99983343       0.43811243 
          0.33345265       0.24998813       0.48129825 
          0.49994651       0.99984124       0.51995708 
          0.33331713       0.24987333       0.40130891 
          0.49994946       0.99986276       0.59990061 
          0.33333111       0.24987191       0.32463632 
          0.49995333       0.99982428       0.67648995 
          0.33203356       0.75174416       0.64843952 
          0.49996674       0.49985675       0.35237543 
          0.33341409       0.74973307       0.56303850 
          0.49994944       0.49985249       0.43823242 
          0.33334630       0.74987136       0.48122053 
          0.49993673       0.49982700       0.52029031 
          0.33329737       0.74982136       0.40128091 
          0.49998195       0.49993252       0.60059764 
          0.33332871       0.74983249       0.32462909 
          0.49993698       0.49986224       0.67655092 
          0.66785736       0.24805469       0.64844523 
          0.83328686       0.99984170       0.35230249 
          0.66648948       0.24996829       0.56304706 
          0.83324695       0.99984863       0.43807533 
          0.66653805       0.24982316       0.48122402 
          0.83311145       0.99973609       0.51992726 
          0.66659972       0.24986787       0.40128214 
          0.83338263       0.99919273       0.59984125 
          0.66661887       0.24984843       0.32463034 
          0.83396482       0.99860521       0.67644031 
          0.66637891       0.74938576       0.64917425 
          0.83329262       0.49985797       0.35230465 
          0.66635619       0.74913932       0.56330567 
          0.83324269       0.49988863       0.43807089 
          0.66643329       0.74971256       0.48130560 
          0.83321032       0.49979456       0.51991138 
          0.66658421       0.74981745       0.40130773 
          0.83337440       0.49968075       0.59983641 
          0.66661845       0.74981488       0.32463738 
          0.83346247       0.49961326       0.67644530 
          0.09855795       0.39774849       0.64165010 
          0.26521174       0.35176429       0.35937044 
          0.06812876       0.14800214       0.35934935 
          0.23440788       0.10300496       0.64173130 
          0.10164141       0.40239531       0.56085507 
          0.26823788       0.34734591       0.44022496 
          0.06510700       0.15245852       0.44017494 
          0.23188540       0.09766881       0.56092375 
          0.10178488       0.40276657       0.47979851 
          0.26854572       0.34725302       0.52132281 
          0.06489715       0.15276181       0.52121931 
          0.23160029       0.09709006       0.47983146 
          0.10101862       0.40157109       0.39806154 
          0.26804803       0.34913982       0.60315871 
          0.06566019       0.15164731       0.60288612 
          0.23230687       0.09819582       0.39808044 
          0.09141777       0.38734941       0.31361975 
          0.25805064       0.36326127       0.68756990 
          0.07408273       0.13794416       0.68728859 
          0.24186870       0.11240147       0.31362417 
          0.09846583       0.89841855       0.64151089 
          0.26520103       0.85174837       0.35935583 
          0.06812092       0.64799473       0.35934869 
          0.23387603       0.60280592       0.64148436 
          0.10162582       0.90248188       0.56084055 
          0.26821244       0.84731745       0.44019406 
          0.06508439       0.65243948       0.44017380 
          0.23164940       0.59774713       0.56086453 
          0.10178697       0.90278727       0.47979918 
          0.26850780       0.84702844       0.52126453 
          0.06476377       0.65276750       0.52122671 
          0.23152971       0.59710203       0.47981587 
          0.10101399       0.90159328       0.39806066 
          0.26763915       0.84844966       0.60298540 
          0.06535985       0.65157023       0.60291194 
          0.23229279       0.59817597       0.39807847 
          0.09141271       0.88735329       0.31362038 
          0.25731115       0.86387937       0.68741301 
          0.07492716       0.63722392       0.68735680 
          0.24186816       0.61236457       0.31362575 
          0.43166642       0.39764766       0.64289065 
          0.59857691       0.35173100       0.35940553 
          0.40136569       0.14793473       0.35938606 
          0.56860430       0.10078281       0.64155348 
          0.43493685       0.40273230       0.56140066 
          0.60144392       0.34725402       0.44023614 
          0.39849270       0.15249237       0.44023459 
          0.56522697       0.09709720       0.56094725 
          0.43508060       0.40282957       0.47998362 
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          0.56487041       0.09690929       0.47984952 
          0.43430045       0.40158467       0.39813672 
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          0.57509192       0.11243869       0.31365474 
          0.43128291       0.89903392       0.64153161 
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          0.56803987       0.60184587       0.64288538 
          0.43466015       0.90262150       0.56094472 
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          0.60151875       0.84663103       0.52136299 
          0.39829037       0.65277186       0.52133110 
          0.56479803       0.59686139       0.47998754 
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          0.89824831       0.09719645       0.56084613 
          0.76835470       0.40259422       0.47981678 
          0.93511105       0.34694894       0.52122874 
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          0.90852490       0.61235268       0.31362543 
          0.48055991       0.45504631       0.86988031 
  
 
 
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        181 
 
 
  
          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 
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          0.00000000       0.50000000       0.00000000 
          0.50000000       0.50000000       0.00000000 
  
  
          0.25000000 
          0.25000000 
          0.25000000 
          0.25000000 
  
 
 
  
   No title
    F  
  
  
   normal
       400.00000000
       613.61400000
         0.00001000
       38
       10
      580
       -1
       -1
       967.00000000
        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  
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      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000
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      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000
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      1.00000000
         -1.00000000
     F  
          0.00000000      0.00000000      1.00000000
     F  
          0.00000000      0.00000000      0.00000000
     F  
   
   
     F  
     F  
   
   
        60
        -5
         2
        400.00000000
    
      T  
      F  
           0.00000000
           0.00000000
           0.30000000
          4
           0.40000000
    
   
   
          0.40000000
          1.00000000
          0.10000000
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          4
      F  
        -45
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          1
          1
          5
    
   
   
     F  
     F  
         0
          1.00000000
       -100.00000000   -100.00000000   -100.00000000
          0.00000000
   
  
  
       64
       42
      168
      128
       84
      336
    F  
  
  
        0
       -1
        0
        2
         0.00000000
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        0
         0.50000000
        -3.00000000
         1.00000000
  
  
         0.00010000
         0.00010000
        1
        1
      256
        16.00000000
  
  
        2
         0.00001000
  
  
        0
         1.11000000      0.73000000      0.72000000
      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
  
  
        2
        4
       -1
    T  
    F  
    F  
    F  
    F  
    F  
  
  
        3
       -1
    F  
        28.08500000     16.00000000     18.99800000
         0.00000000      0.00000000      0.00000000
         1.00000000      1.00000000      1.00000000
    T  
  
   T  
   F  
       0
   F  
       0
  
   --
        1
    F  
   
    F  
    F  
    F  
    F  
    F  
        -1.00000000
        0
        0
         0.00000000
         0.00000000
         0.00000000
         1.00000000
         1.00000000
         1.00000000
         1.00000000
        1
        1
        1
    F  
    F  
    F  
        0
        0
    F  
         0.00000000
         0.00000000
        0
  
  
    F  
        -0.84910000
         0.12340000
         1.00000000
         0.00000000
  
  
        0
        11.60776521
         1.00000000
  
  
    F  
    F  
    F  
    F  
        0
         0.10000000
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         0.00000000
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    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  
  
 
 
       181 
         3 
  
   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
    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
    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
    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
    F    3
   
  
  
   type
   atomspertype
   element
   mass
   valence
   pseudopotential
   
      60Si     28.08500000      4.00000000  PAW_PBE Si 05Jan2001                  
     120O      16.00000000      6.00000000  PAW_PBE O 08Apr2002                   
       1F      18.99800000      7.00000000  PAW_PBE F 08Apr2002                   
   
  
 
 
  
   
          12.54222000       0.00000000       0.00000000 
           0.00000000       8.36148000       0.00000000 
           0.00000000       0.00000000      33.39015000 
   
      3501.67583981 
   
           0.07973070       0.00000000       0.00000000 
           0.00000000       0.11959605       0.00000000 
           0.00000000       0.00000000       0.02994895 
   
  
  
          0.99963673       0.25014674       0.64889273 
          0.16665322       0.99984173       0.35230068 
          0.00005395       0.24971917       0.56306228 
          0.16666244       0.99987357       0.43807315 
          0.99993243       0.24983168       0.48120232 
          0.16675894       0.99995776       0.51992065 
          0.99995575       0.24986498       0.40126403 
          0.16645421       0.00048042       0.59982925 
          0.99997493       0.24983902       0.32460450 
          0.16586925       0.00104972       0.67644772 
          0.00024181       0.74954366       0.64887997 
          0.16665217       0.49981505       0.35230222 
          0.99980044       0.74996921       0.56305485 
          0.16666053       0.49982986       0.43807120 
          0.99992698       0.74986672       0.48120026 
          0.16665370       0.49991944       0.51990996 
          0.99996616       0.74987037       0.40126333 
          0.16649665       0.49999861       0.59982935 
          0.99997595       0.74984179       0.32460317 
          0.16643970       0.50010124       0.67644471 
          0.33332112       0.24999163       0.64914842 
          0.49996577       0.99985331       0.35232196 
          0.33347896       0.25053520       0.56327964 
          0.49994740       0.99983343       0.43811243 
          0.33345265       0.24998813       0.48129825 
          0.49994651       0.99984124       0.51995708 
          0.33331713       0.24987333       0.40130891 
          0.49994946       0.99986276       0.59990061 
          0.33333111       0.24987191       0.32463632 
          0.49995333       0.99982428       0.67648995 
          0.33203356       0.75174416       0.64843952 
          0.49996674       0.49985675       0.35237543 
          0.33341409       0.74973307       0.56303850 
          0.49994944       0.49985249       0.43823242 
          0.33334630       0.74987136       0.48122053 
          0.49993673       0.49982700       0.52029031 
          0.33329737       0.74982136       0.40128091 
          0.49998195       0.49993252       0.60059764 
          0.33332871       0.74983249       0.32462909 
          0.49993698       0.49986224       0.67655092 
          0.66785736       0.24805469       0.64844523 
          0.83328686       0.99984170       0.35230249 
          0.66648948       0.24996829       0.56304706 
          0.83324695       0.99984863       0.43807533 
          0.66653805       0.24982316       0.48122402 
          0.83311145       0.99973609       0.51992726 
          0.66659972       0.24986787       0.40128214 
          0.83338263       0.99919273       0.59984125 
          0.66661887       0.24984843       0.32463034 
          0.83396482       0.99860521       0.67644031 
          0.66637891       0.74938576       0.64917425 
          0.83329262       0.49985797       0.35230465 
          0.66635619       0.74913932       0.56330567 
          0.83324269       0.49988863       0.43807089 
          0.66643329       0.74971256       0.48130560 
          0.83321032       0.49979456       0.51991138 
          0.66658421       0.74981745       0.40130773 
          0.83337440       0.49968075       0.59983641 
          0.66661845       0.74981488       0.32463738 
          0.83346247       0.49961326       0.67644530 
          0.09855795       0.39774849       0.64165010 
          0.26521174       0.35176429       0.35937044 
          0.06812876       0.14800214       0.35934935 
          0.23440788       0.10300496       0.64173130 
          0.10164141       0.40239531       0.56085507 
          0.26823788       0.34734591       0.44022496 
          0.06510700       0.15245852       0.44017494 
          0.23188540       0.09766881       0.56092375 
          0.10178488       0.40276657       0.47979851 
          0.26854572       0.34725302       0.52132281 
          0.06489715       0.15276181       0.52121931 
          0.23160029       0.09709006       0.47983146 
          0.10101862       0.40157109       0.39806154 
          0.26804803       0.34913982       0.60315871 
          0.06566019       0.15164731       0.60288612 
          0.23230687       0.09819582       0.39808044 
          0.09141777       0.38734941       0.31361975 
          0.25805064       0.36326127       0.68756990 
          0.07408273       0.13794416       0.68728859 
          0.24186870       0.11240147       0.31362417 
          0.09846583       0.89841855       0.64151089 
          0.26520103       0.85174837       0.35935583 
          0.06812092       0.64799473       0.35934869 
          0.23387603       0.60280592       0.64148436 
          0.10162582       0.90248188       0.56084055 
          0.26821244       0.84731745       0.44019406 
          0.06508439       0.65243948       0.44017380 
          0.23164940       0.59774713       0.56086453 
          0.10178697       0.90278727       0.47979918 
          0.26850780       0.84702844       0.52126453 
          0.06476377       0.65276750       0.52122671 
          0.23152971       0.59710203       0.47981587 
          0.10101399       0.90159328       0.39806066 
          0.26763915       0.84844966       0.60298540 
          0.06535985       0.65157023       0.60291194 
          0.23229279       0.59817597       0.39807847 
          0.09141271       0.88735329       0.31362038 
          0.25731115       0.86387937       0.68741301 
          0.07492716       0.63722392       0.68735680 
          0.24186816       0.61236457       0.31362575 
          0.43166642       0.39764766       0.64289065 
          0.59857691       0.35173100       0.35940553 
          0.40136569       0.14793473       0.35938606 
          0.56860430       0.10078281       0.64155348 
          0.43493685       0.40273230       0.56140066 
          0.60144392       0.34725402       0.44023614 
          0.39849270       0.15249237       0.44023459 
          0.56522697       0.09709720       0.56094725 
          0.43508060       0.40282957       0.47998362 
          0.60159808       0.34693093       0.52133422 
          0.39836180       0.15307356       0.52135567 
          0.56487041       0.09690929       0.47984952 
          0.43430045       0.40158467       0.39813672 
          0.60094296       0.34810711       0.60320941 
          0.39928066       0.15276468       0.60318089 
          0.56562409       0.09810584       0.39809249 
          0.42485049       0.38729221       0.31367094 
          0.59211082       0.36193877       0.68716241 
          0.40875937       0.13730462       0.68755413 
          0.57509192       0.11243869       0.31365474 
          0.43128291       0.89903392       0.64153161 
          0.59855622       0.85173788       0.35938652 
          0.40134706       0.64793748       0.35940300 
          0.56803987       0.60184587       0.64288538 
          0.43466015       0.90262150       0.56094472 
          0.60141172       0.84721374       0.44023671 
          0.39845615       0.65245144       0.44023571 
          0.56492048       0.59694819       0.56139769 
          0.43501712       0.90278608       0.47984911 
          0.60151875       0.84663103       0.52136299 
          0.39829037       0.65277186       0.52133110 
          0.56479803       0.59686139       0.47998754 
          0.43428170       0.90156460       0.39808977 
          0.60054844       0.84690225       0.60319737 
          0.39892546       0.65159779       0.60320361 
          0.56560108       0.59809436       0.39813926 
          0.42484140       0.88724343       0.31364959 
          0.59113067       0.86235567       0.68757230 
          0.40792311       0.63812378       0.68715790 
          0.57508160       0.61238780       0.31367694 
          0.76608347       0.39685770       0.64147572 
          0.93182882       0.35170509       0.35934921 
          0.73472710       0.14792797       0.35936177 
          0.90139944       0.10127271       0.64151838 
          0.76823437       0.40195323       0.56086665 
          0.93481572       0.34727937       0.44017516 
          0.73168564       0.15238034       0.44019633 
          0.89824831       0.09719645       0.56084613 
          0.76835470       0.40259422       0.47981678 
          0.93511105       0.34694894       0.52122874 
          0.73138201       0.15267019       0.52126751 
          0.89809757       0.09690778       0.47980226 
          0.76762963       0.40150580       0.39807976 
          0.93454007       0.34813122       0.60291240 
          0.73224058       0.15126841       0.60298852 
          0.89891172       0.09811070       0.39806287 
          0.75806705       0.38732424       0.31363331 
          0.92496098       0.36251877       0.68737209 
          0.74256830       0.13584785       0.68742687 
          0.90852934       0.11235063       0.31362362 
          0.76540231       0.89663571       0.64173774 
          0.93182293       0.85170167       0.35934948 
          0.73471626       0.64791565       0.35937451 
          0.90133330       0.60193605       0.64164748 
          0.76797825       0.90199725       0.56093412 
          0.93479938       0.84726285       0.44017539 
          0.73165400       0.65235299       0.44022782 
          0.89822520       0.59732883       0.56086004 
          0.76829015       0.90260545       0.47983565 
          0.93497917       0.84694086       0.52122001 
          0.73130734       0.65242503       0.52133203 
          0.89809620       0.59695006       0.47980106 
          0.76761662       0.90148963       0.39808269 
          0.93422419       0.84804181       0.60288849 
          0.73175774       0.65048449       0.60317750 
          0.89890222       0.59812771       0.39806253 
          0.75806655       0.88729342       0.31362925 
          0.92577255       0.86173464       0.68728739 
          0.74187519       0.63643280       0.68757954 
          0.90852490       0.61235268       0.31362543 
          0.48055991       0.45504631       0.86988031 
  
 
 
  
   
   
   
        913.82676839 
     717651.88979239 
    -771015.01730448 
       2923.19633532 
      47412.57301429 
     -46577.91816411 
         -0.01006894 
      -1828.34308380 
      58714.97800607 
       8195.17529512 
       8195.18536406 
       8195.17865143 
   
  
  
   
   
   
       -473.17948666 
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       -473.18224491 
   
  
  
   
   
   
      -1484.33240709 
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      -1484.30541023 
   
  
  
   
   
   
      -1509.73860773 
      -1509.65670581 
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      -1510.51369548 
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      -1510.48638108 
   
  
  
   
   
   
      -1361.88832582 
      -1361.96488087 
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      -1360.52173693 
      -1360.43588197 
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      -1362.07558769 
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      -1358.86775331 
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      -1358.84501664 
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      -1358.84913947 
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      -1358.84554647 
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      -1358.85379244 
      -1358.85091979 
      -1358.85283489 
   
  
  
   
   
   
      -1358.85243750 
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      -1358.85475064 
      -1358.82384125 
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      -1358.85628858 
      -1358.82542274 
      -1358.84599996