vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2023 09 06 
  01:05:54 
 
 
  No title
       0
  Normal
  Normal (blocked Davidson)
   F  
       1
       2
       1
     180
       2
      -1
        0.00010000
       -0.02000000
       0
       2
       1
      400.00000000
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  Auto
       1
        0.20000000
       1
   F  
   F  
       1
 
 
  
   
    
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       7848.63264950 
    
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           0.65751549       0.61615643       0.69553120 
           0.55839531       0.61938942       0.66903942 
           0.83884328       0.24658911       0.44347279 
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          0.50000000 
          0.50000000 
  
 
 
  
   No title
    F  
  
  
   normal
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       10
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       -1
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     T  
     T  
   
   
     T  
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     F  
   
   
         0
         2
         1
   
   
         1
     F  
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         -1.00000000
     F  
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     F  
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     F  
   
   
     F  
     F  
   
   
       180
        -5
         2
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      T  
      F  
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          4
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          0.40000000
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          4
      F  
        -45
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          1
          5
    
   
   
     F  
     F  
         0
          1.00000000
       -100.00000000   -100.00000000   -100.00000000
          0.00000000
   
  
  
       64
       96
      160
      128
      192
      320
    F  
  
  
        0
       -1
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        2
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         0.00010000
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        2
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        1
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    F  
    F  
    F  
    F  
    F  
    F  
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        1
        4
       -1
    T  
    F  
    F  
    F  
    F  
    F  
  
  
        3
       -1
    F  
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    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
        20.56410301
         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
      180
        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  
  
 
 
       229 
         6 
  
   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
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    Ge   2
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    Al   4
    Al   4
    Al   4
    Al   4
    Al   4
    Al   4
    Al   4
    Al   4
    Al   4
    Al   4
    Al   4
    Al   4
    Al   4
    Al   4
    Al   4
    Al   4
    Al   4
    Al   4
    Al   4
    Al   4
    Al   4
    Al   4
    Al   4
    Al   4
    C    5
    C    5
    C    5
    C    5
    C    5
    C    5
    C    5
    C    5
    C    5
    C    5
    C    5
    C    5
    C    5
    C    5
    C    5
    C    5
    C    5
    C    5
    C    5
    C    5
    C    5
    C    5
    C    5
    C    5
    C    5
    C    5
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
    H    6
   
  
  
   type
   atomspertype
   element
   mass
   valence
   pseudopotential
   
      28Si     28.08500000      4.00000000  PAW_PBE Si 05Jan2001                  
      36Ge     72.61000000     14.00000000  PAW_PBE Ge_d 03Jul2007                
      37O      16.00000000      6.00000000  PAW_PBE O 08Apr2002                   
      24Al     26.98100000      3.00000000  PAW_PBE Al 04Jan2001                  
      26C      12.01100000      4.00000000  PAW_PBE C 08Apr2002                   
      78H       1.00000000      1.00000000  PAW_PBE H 15Jun2001                   
   
  
 
 
  
   
          12.47140000       0.00000000       0.00000000 
          -3.04885115      19.22970392       0.00000000 
           0.00000000       0.00000000      32.72700000 
   
      7848.63264950 
   
           0.08018346       0.01271301       0.00000000 
           0.00000000       0.05200288       0.00000000 
           0.00000000       0.00000000       0.03055581 
   
  
  
          0.35360986       0.01456922       0.33538995 
          0.04110986       0.95206922       0.33538995 
          0.91610986       0.82706922       0.25184303 
          0.19735986       0.98331922       0.29361649 
          0.66610986       0.57706922       0.25184303 
          0.97860986       0.63956922       0.25184303 
          0.94735986       0.73331922       0.29361649 
          0.82235986       0.60831922       0.21006957 
          0.72860986       0.38956922       0.25184303 
          0.69735986       0.48331922       0.29361649 
          0.29110986       0.20206922       0.33538995 
          0.16610986       0.07706922       0.25184303 
          0.47860986       0.13956922       0.25184303 
          0.32235986       0.10831922       0.21006957 
          0.85360986       0.01456922       0.25184303 
          0.38485986       0.92081922       0.21006957 
          0.60360986       0.76456922       0.25184303 
          0.00985986       0.54581922       0.29361649 
          0.32235986       0.60831922       0.29361649 
          0.10360986       0.26456922       0.25184303 
          0.07235986       0.35831922       0.29361649 
          0.94735986       0.23331922       0.21006957 
          0.00985986       0.04581922       0.21006957 
          0.88485986       0.92081922       0.29361649 
          0.63485986       0.67081922       0.29361649 
          0.38485986       0.42081922       0.29361649 
          0.25985986       0.29581922       0.21006957 
          0.13485986       0.17081922       0.29361649 
          0.22860986       0.88956922       0.25184303 
          0.10360986       0.76456922       0.33538995 
          0.07235986       0.85831922       0.21006957 
          0.79110986       0.70206922       0.33538995 
          0.85360986       0.51456922       0.33538995 
          0.54110986       0.45206922       0.33538995 
          0.41610986       0.32706922       0.25184303 
          0.60360986       0.26456922       0.33538995 
          0.57235986       0.35831922       0.21006957 
          0.44735986       0.23331922       0.29361649 
          0.54110986       0.95206922       0.25184303 
          0.50985986       0.04581922       0.29361649 
          0.72860986       0.88956922       0.33538995 
          0.69735986       0.98331922       0.21006957 
          0.41610986       0.82706922       0.33538995 
          0.29110986       0.70206922       0.25184303 
          0.25985986       0.79581922       0.29361649 
          0.57235986       0.85831922       0.29361649 
          0.47860986       0.63956922       0.33538995 
          0.44735986       0.73331922       0.21006957 
          0.16610986       0.57706922       0.33538995 
          0.13485986       0.67081922       0.21006957 
          0.04110986       0.45206922       0.25184303 
          0.35360986       0.51456922       0.25184303 
          0.22860986       0.38956922       0.33538995 
          0.19735986       0.48331922       0.21006957 
          0.91610986       0.32706922       0.33538995 
          0.88485986       0.42081922       0.21006957 
          0.79110986       0.20206922       0.25184303 
          0.75985986       0.29581922       0.29361649 
          0.97860986       0.13956922       0.33538995 
          0.66610986       0.07706922       0.33538995 
          0.63485986       0.17081922       0.21006957 
          0.82235986       0.10831922       0.29361649 
          0.75985986       0.79581922       0.21006957 
          0.50985986       0.54581922       0.21006957 
          0.84530750       0.88076063       0.42315121 
          0.89164664       0.01962227       0.44205494 
          0.75441385       0.13978689       0.38135603 
          0.93087260       0.23573100       0.34980801 
          0.97516738       0.13922375       0.39514487 
          0.74477889       0.39396448       0.37926373 
          0.91461621       0.49972911       0.38633130 
          0.94441574       0.36063849       0.39204204 
          0.77520374       0.59941463       0.35481116 
          0.88329378       0.75848345       0.40964991 
          0.99397354       0.64204543       0.40152744 
          0.00462277       0.88884800       0.36537904 
          0.44372109       0.72619494       0.35934165 
          0.67142944       0.80074209       0.38447126 
          0.58708002       0.65462333       0.38721022 
          0.41425951       0.96229388       0.36973582 
          0.57094757       0.06684068       0.38457494 
          0.67178261       0.97283031       0.35392626 
          0.39494906       0.19312512       0.36414101 
          0.54032756       0.32522239       0.37201399 
          0.59515233       0.21432756       0.38492945 
          0.40579938       0.47198223       0.42492946 
          0.53185339       0.54747816       0.34723525 
          0.63413117       0.50351101       0.41400442 
          0.11517577       0.28729949       0.41311698 
          0.23990053       0.42764251       0.38876919 
          0.15314280       0.54311403       0.38855495 
          0.19334270       0.67604210       0.35053179 
          0.35308417       0.61358372       0.40605094 
          0.10168269       0.79181827       0.39035619 
          0.21591670       0.92290738       0.40413295 
          0.32240809       0.79785253       0.38704834 
          0.05896565       0.03315845       0.35609513 
          0.20108504       0.17488627       0.37841976 
          0.29429833       0.05253285       0.37584967 
          0.33886833       0.30022069       0.40680821 
          0.57107580       0.59531657       0.62811154 
          0.87320182       0.19519981       0.39477323 
          0.85518079       0.41946812       0.41055020 
          0.91982157       0.68278438       0.43787879 
          0.85742335       0.94039149       0.46301919 
          0.55654493       0.73823535       0.39772341 
          0.76775361       0.79772777       0.42553156 
          0.55865827       0.97478456       0.38853436 
          0.63498788       0.14183433       0.41144552 
          0.46334358       0.25292714       0.40205817 
          0.61694885       0.40532213       0.39542779 
          0.53191254       0.48120459       0.45219476 
          0.64578597       0.57801979       0.38084304 
          0.31948106       0.38398265       0.42657723 
          0.28824834       0.52010254       0.41020184 
          0.31534511       0.62948892       0.46033577 
          0.30234647       0.70047107       0.38773648 
          0.22532057       0.83770762       0.41666016 
          0.32526723       0.98470257       0.41352963 
          0.16362088       0.08207659       0.38523225 
          0.21708629       0.23891646       0.42156190 
          0.98283402       0.09307490       0.44305732 
          0.00947790       0.32059735       0.43297454 
          0.02229651       0.56056564       0.41200978 
          0.98324732       0.83955570       0.41065379 
          0.53574316       0.50242569       0.51126384 
          0.65751549       0.61615643       0.69553120 
          0.55839531       0.61938942       0.66903942 
          0.83884328       0.24658911       0.44347279 
          0.82043012       0.41943486       0.46932285 
          0.99299425       0.71512458       0.49094495 
          0.81048387       0.93423086       0.52012754 
          0.49169758       0.74607505       0.45116997 
          0.72109761       0.77347631       0.48211256 
          0.57322205       0.92770075       0.44016976 
          0.64971844       0.11895599       0.46970455 
          0.47614437       0.22172687       0.45938293 
          0.56858862       0.37815584       0.45562813 
          0.78131585       0.62392675       0.45527912 
          0.29989895       0.37003404       0.48646955 
          0.25066827       0.52547256       0.47271255 
          0.34591928       0.65441064       0.51819205 
          0.20869832       0.69106325       0.44291505 
          0.27408125       0.84185041       0.47562295 
          0.37854653       0.01758361       0.46743840 
          0.13801006       0.05455787       0.44394074 
          0.22481155       0.19843769       0.47640418 
          0.96367197       0.14289840       0.49473974 
          0.02639670       0.34899879       0.49084034 
          0.01016145       0.54057927       0.47131519 
          0.02907895       0.87682836       0.46637745 
          0.61880542       0.50253622       0.52335579 
          0.50685123       0.54854642       0.52365779 
          0.48421719       0.45728023       0.52579362 
          0.67980746       0.56364185       0.69463664 
          0.64244518       0.62921475       0.72754720 
          0.72782626       0.65338521       0.68477500 
          0.53811911       0.67261606       0.66864695 
          0.48726332       0.58487040       0.68128362 
          0.63540313       0.62340101       0.61644367 
          0.87632708       0.28074530       0.46800228 
          0.76987858       0.27077220       0.43247654 
          0.80600446       0.20042595       0.46159918 
          0.88822859       0.43289985       0.49026971 
          0.76769780       0.45916209       0.47396689 
          0.77533110       0.36944887       0.47962141 
          0.06709816       0.75373437       0.49160345 
          0.93297208       0.73647094       0.50992021 
          0.01105818       0.66955099       0.50809665 
          0.86020855       0.97682291       0.53700898 
          0.72541691       0.94233806       0.52333625 
          0.81844118       0.88520078       0.53552631 
          0.40419508       0.74822526       0.45040932 
          0.50587589       0.70224539       0.47054945 
          0.52500425       0.79273641       0.46843342 
          0.79712604       0.77517680       0.49949049 
          0.67735939       0.81265457       0.49569489 
          0.67331242       0.72227695       0.48780992 
          0.60749671       0.96676791       0.46290588 
          0.49878535       0.89843061       0.45315791 
          0.63108204       0.89118199       0.43605204 
          0.66762406       0.16199669       0.49156901 
          0.57616257       0.08607568       0.48106069 
          0.71594545       0.08745853       0.47147805 
          0.42651457       0.24519696       0.48145887 
          0.44986568       0.16528813       0.46195638 
          0.55989051       0.23140556       0.47087679 
          0.60782772       0.39773874       0.48436062 
          0.49084315       0.34722064       0.46421384 
          0.62026912       0.33920061       0.44708455 
          0.77186893       0.62612169       0.48876591 
          0.70596207       0.63969107       0.44314013 
          0.78065472       0.56901210       0.44757184 
          0.32520425       0.41715553       0.50451985 
          0.21772330       0.34905572       0.49648256 
          0.35104143       0.33226735       0.49663067 
          0.19199875       0.54764744       0.49164642 
          0.20155756       0.47482377       0.46476096 
          0.31465304       0.51316445       0.49309758 
          0.26535442       0.64617692       0.53312711 
          0.39613830       0.62306192       0.53562576 
          0.37980061       0.70931759       0.52263043 
          0.14607996       0.69865934       0.41998934 
          0.15631934       0.64731109       0.45853587 
          0.21544497       0.73381281       0.46473779 
          0.35434328       0.82614727       0.47973162 
          0.28234943       0.89618571       0.48596967 
          0.22064571       0.81200261       0.49832487 
          0.40741441       0.07378398       0.46841995 
          0.31033946       0.00702061       0.48907260 
          0.44335145       0.99158689       0.47977104 
          0.10557510       0.05728369       0.47516317 
          0.13399056       0.99838073       0.43800553 
          0.22261186       0.07753524       0.45090870 
          0.24894305       0.24138080       0.49787845 
          0.14581044       0.17255125       0.48714306 
          0.28319799       0.16250225       0.48069268 
          0.99041300       0.19901051       0.49790462 
          0.87686780       0.13169989       0.50271796 
          0.00573394       0.11801371       0.51906028 
          0.07801316       0.39909918       0.49654424 
          0.95101861       0.34935462       0.50806033 
          0.06789095       0.30899906       0.50504106 
          0.05819656       0.58233577       0.48915773 
          0.92571370       0.54320657       0.47990803 
          0.02962875       0.49131675       0.48286744 
          0.02654367       0.93374235       0.46638939 
          0.96959876       0.85163332       0.48881642 
          0.10835032       0.87447212       0.48011817 
  
  
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         -3.00000000       0.00000000       0.00010000       0.00010000 
  
 
 
  
      36.66   36.86
      38.36   38.55
   
        773.09346045 
     504027.06878106 
    -595166.31180670 
       3289.03156363 
      85984.79816423 
    -100465.99103074 
          0.01618099 
      -4984.36834373 
     118427.16121518 
      11884.49818437 
      11884.48200338 
      11884.49279070 
   
  
  
      40.50   40.50
      40.50   40.50
   
       1238.73079639 
       1238.70927966 
       1238.72362415 
   
  
  
      44.09   44.09
      44.09   44.09
   
      -1110.90760092 
      -1110.94165190 
      -1110.91895125 
   
  
  
      41.14   41.13
      41.14   41.14
   
      -1342.93975040 
      -1343.02633870 
      -1342.96861317 
   
  
  
      45.08   45.09
      46.75   46.75
   
      -1354.53875130 
      -1354.62312544 
      -1354.56687601 
   
  
  
      45.35   45.35
      50.28   50.29
   
      -1211.32457122 
      -1211.31206641 
      -1211.32040295 
   
  
  
      43.91   43.92
      50.83   50.85
   
      -1209.49124669 
      -1209.51931174 
      -1209.50060171 
   
  
  
      42.44   42.44
      46.48   46.49
   
      -1207.37234651 
      -1207.34470447 
      -1207.36313250 
   
  
  
      40.48   40.48
      44.38   44.38
   
      -1206.43020023 
      -1206.43631169 
      -1206.43223738 
   
  
  
      38.87   38.87
      42.95   42.95
   
      -1206.07197359 
      -1206.03937488 
      -1206.06110735 
   
  
  
      41.97   41.97
      46.40   46.40
   
      -1205.81826626 
      -1205.82020008 
      -1205.81891087 
   
  
  
      39.59   39.59
      43.50   43.50
   
      -1205.78761156 
      -1205.78264005 
      -1205.78595439 
   
  
  
      39.10   39.11
      42.95   42.97
   
      -1205.77971758 
      -1205.77372228 
      -1205.77771915 
   
  
  
      40.96   40.95
      45.87   45.87
   
      -1205.77657384 
      -1205.77023235 
      -1205.77446001 
   
  
  
      42.31   42.30
      50.10   50.19
   
      -1205.76960021 
      -1205.76464470 
      -1205.76794837 
   
  
  
      41.30   41.29
      45.21   45.20
   
      -1205.76735133 
      -1205.76184566 
      -1205.76551611 
   
  
  
      40.72   40.72
      44.89   44.89
   
      -1205.76964614 
      -1205.76467709 
      -1205.76798979 
   
  
  
      42.69   42.70
      46.65   46.65
   
      -1205.77194410 
      -1205.76727077 
      -1205.77038632 
   
  
  
      38.72   38.73
      42.79   42.79
   
      -1205.77718938 
      -1205.77275114 
      -1205.77570996 
   
  
  
      37.37   37.38
      41.55   41.55
   
      -1205.78122349 
      -1205.77675278 
      -1205.77973325 
   
  
  
      41.08   41.09
      45.72   45.73
   
      -1205.78415995 
      -1205.77968593 
      -1205.78266861 
   
  
  
      35.16   35.17
      40.20   40.22
   
      -1205.78627852 
      -1205.78180307 
      -1205.78478671 
   
  
  
      30.23   30.23
      34.67   34.68
   
      -1205.78837074 
      -1205.78390855 
      -1205.78688334 
   
  
  
      32.89   32.89
      36.70   36.70
   
      -1205.79035071 
      -1205.78593641 
      -1205.78887927 
   
  
  
      27.79   27.81
      31.38   31.40
   
      -1205.79099933 
      -1205.78657104 
      -1205.78952324 
   
  
  
      27.69   27.70
      32.17   32.18
   
      -1205.79202034 
      -1205.78760979 
      -1205.79055015 
   
  
  
      27.12   27.13
      31.23   31.24
   
      -1205.79257667 
      -1205.78815312 
      -1205.79110216 
   
  
  
      27.34   27.35
      31.37   31.38
   
      -1205.79313497 
      -1205.78873012 
      -1205.79166669 
   
  
  
      26.21   26.22
      29.64   29.64
   
      -1205.79331672 
      -1205.78890784 
      -1205.79184709 
   
  
  
      20.96   20.96
      22.63   22.64
   
        773.09346045 
     504027.06878106 
    -597395.61607160 
       3390.96284225 
     126949.19187008 
    -141541.71498316 
         -0.00440561 
     -15835.93610219 
     118427.16121518 
      -1205.79339355 
      -1205.78898794 
      -1205.79192501