vasp 
  6.1.1  
  19Jun20 (build Jun 25 2020 02:42:34) complex                          parallel 
  Lin64 
  2021 06 20 
  09:02:44 
 
 
   No title
       0
   Normal
   Normal (blocked Davidson)
   F  
       1
       2
       1
      60
       2
      -1
        0.00001000
       -0.02000000
       0
       2
       1
      250.00000000
        1.11000000      0.32000000
   Auto
       1
        0.20000000
       1
   F  
   F  
       4
   Normal (blocked Davidson)
      60
       1
        0.00001000
       1
 
 
  
   
          15.36108000       0.00000000       0.00000000 
           0.00000000      15.36108000       0.00000000 
           0.00000000       0.00000000      20.86192000 
   
      4922.63661360 
   
           0.06509959       0.00000000       0.00000000 
           0.00000000       0.06509959       0.00000000 
           0.00000000       0.00000000       0.04793423 
   
  
  
          0.06325534       0.13082954       0.60327575 
          0.18765190       0.12536346       0.40531697 
          0.06265190       0.12536346       0.33952292 
          0.18957796       0.13181760       0.66992438 
          0.06261622       0.00092914       0.53881019 
          0.18765190       0.00036346       0.47034958 
          0.06265190       0.00036346       0.27368011 
          0.14018201       0.00308668       0.71798347 
          0.06325701       0.37431321       0.60715915 
          0.18765190       0.37536346       0.40531697 
          0.06265190       0.37536346       0.33952292 
          0.19361890       0.36620182       0.66967774 
          0.06272429       0.25386881       0.53583782 
          0.18765190       0.25036346       0.47034958 
          0.06265190       0.25036346       0.27368011 
          0.22935699       0.24887883       0.73863296 
          0.06139705       0.62410026       0.60468111 
          0.18765190       0.62536346       0.40531697 
          0.06265190       0.62536346       0.33952292 
          0.19152665       0.62375340       0.66626925 
          0.06252997       0.49830097       0.53890292 
          0.18765190       0.50036346       0.47034958 
          0.06265190       0.50036346       0.27368011 
          0.25692124       0.49616603       0.70199182 
          0.06161730       0.86880965       0.60030949 
          0.18765190       0.87536346       0.40531697 
          0.06265190       0.87536346       0.33952292 
          0.18591390       0.87664377       0.66654074 
          0.06276693       0.74543611       0.53488525 
          0.18765190       0.75036346       0.47034958 
          0.06265190       0.75036346       0.27368011 
          0.25627909       0.75079082       0.70313412 
          0.31162619       0.11985218       0.60127480 
          0.43765190       0.12536346       0.40531697 
          0.31265190       0.12536346       0.33952292 
          0.43916384       0.12580707       0.66518028 
          0.31240273       0.00098850       0.53245597 
          0.43765190       0.00036346       0.47034958 
          0.31265190       0.00036346       0.27368011 
          0.50023548       0.99727969       0.70526170 
          0.31336930       0.37482089       0.59663563 
          0.43765190       0.37536346       0.40531697 
          0.31265190       0.37536346       0.33952292 
          0.43399665       0.38383208       0.66846005 
          0.31218522       0.24653185       0.53551663 
          0.43765190       0.25036346       0.47034958 
          0.31265190       0.25036346       0.27368011 
          0.37458219       0.25354070       0.70405542 
          0.31611623       0.62675676       0.59603481 
          0.43765190       0.62536346       0.40531697 
          0.31265190       0.62536346       0.33952292 
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          0.31287639       0.75493518       0.53541060 
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          0.31265190       0.75036346       0.27368011 
          0.40126537       0.74822344       0.73551153 
          0.56455157       0.13240389       0.59990387 
          0.68765190       0.12536346       0.40531697 
          0.56265190       0.12536346       0.33952292 
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          0.68765190       0.00036346       0.47034958 
          0.56265190       0.00036346       0.27368011 
          0.64608346       0.99925018       0.73360305 
          0.56394722       0.37726946       0.60632524 
          0.68765190       0.37536346       0.40531697 
          0.56265190       0.37536346       0.33952292 
          0.69426012       0.38208028       0.66851729 
          0.56292803       0.25625120       0.53560167 
          0.68765190       0.25036346       0.47034958 
          0.56265190       0.25036346       0.27368011 
          0.75004850       0.24935810       0.70440186 
          0.56293428       0.62521556       0.60843318 
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          0.56265190       0.62536346       0.33952292 
          0.69546323       0.62362239       0.67029308 
          0.56262803       0.50183506       0.53903909 
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          0.72703815       0.50103709       0.73697345 
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          0.68765190       0.87536346       0.40531697 
          0.56265190       0.87536346       0.33952292 
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          0.56249613       0.74620833       0.53638902 
          0.68765190       0.75036346       0.47034958 
          0.56265190       0.75036346       0.27368011 
          0.73153932       0.75122427       0.73359380 
          0.81284559       0.12013321       0.60266737 
          0.93765190       0.12536346       0.40531697 
          0.81265190       0.12536346       0.33952292 
          0.93641959       0.13231564       0.66968933 
          0.81262900       0.00102978       0.53343410 
          0.93765190       0.00036346       0.47034958 
          0.81265190       0.00036346       0.27368011 
          0.99187775       0.00105887       0.70966302 
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          0.93765190       0.37536346       0.40531697 
          0.81265190       0.37536346       0.33952292 
          0.93268879       0.36709158       0.66927044 
          0.81293786       0.24636503       0.53580413 
          0.93765190       0.25036346       0.47034958 
          0.81265190       0.25036346       0.27368011 
          0.89585395       0.24940744       0.73777192 
          0.81129821       0.62865210       0.59632692 
          0.93765190       0.62536346       0.40531697 
          0.81265190       0.62536346       0.33952292 
          0.93161308       0.63008841       0.66917012 
          0.81268614       0.50154289       0.53332779 
          0.93765190       0.50036346       0.47034958 
          0.81265190       0.50036346       0.27368011 
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          0.81091751       0.88203934       0.60251791 
          0.93765190       0.87536346       0.40531697 
          0.81265190       0.87536346       0.33952292 
          0.93650393       0.87056254       0.66839497 
          0.81225536       0.75636188       0.53540437 
          0.93765190       0.75036346       0.47034958 
          0.81265190       0.75036346       0.27368011 
          0.88760268       0.75250041       0.73122239 
          0.70750504       0.74693574       0.84731914 
          0.75095444       0.66746752       0.87506753 
          0.61208947       0.74230239       0.86087260 
          0.90739946       0.75980971       0.80208585 
          0.74101572       0.82011924       0.88900252 
  
 
 
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        133 
 
 
  
          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
       250.00000000
       400.00000000
         0.00001000
       38
       10
      328
       -1
       -1
       520.00000000
        0
        0
        0
        0
         0.00000000
   
         1
          0.20000000
          0.50000000
     T  
     T  
   
   
     T  
         -0.00050000     -0.00050000
      -100
         2
     F  
   
   
         0
         2
         1
   
   
         1
     F  
          1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000
      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000
      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000
      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000
      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000
      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000
      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000
         -1.00000000
     F  
          0.00000000      0.00000000      1.00000000
     F  
          0.00000000      0.00000000      0.00000000
     F  
   
   
     F  
     F  
   
   
        60
        -5
         2
        250.00000000
    
      T  
      F  
           0.00000000
           0.00000001
           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
   
  
  
       60
       60
       84
      120
      120
      168
    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      0.32000000
      301
        10.00000000
       -10.00000000
         0.00000000
  
  
        1
    F  
    F  
    F  
    F  
    F  
    F  
    F  
    F  
         0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000
  
  
        4
        4
       -1
    T  
    F  
    F  
    F  
    F  
    F  
  
  
        3
       -1
    F  
        28.08500000      1.00000000
         0.00000000      0.00000000
         1.00000000      1.00000000
    T  
  
   T  
   F  
       0
   F  
       0
  
   --
        1
    F  
   
    F  
    F  
    F  
    F  
    F  
        -1.00000000
        0
        0
         0.00000000
         0.00000000
         0.00000000
         1.00000000
         1.00000000
         1.00000000
         1.00000000
        1
        1
        1
    F  
    F  
    F  
        0
        0
    F  
         0.00000000
         0.00000000
        0
  
  
    F  
        -0.84910000
         0.12340000
         1.00000000
         0.00000000
  
  
        0
        22.20738322
         1.00000000
  
  
    F  
    F  
    F  
    F  
        0
         0.10000000
        -1.00000000
         0.00200000
        -0.10000000
         0.00000000
         0.00000000      0.00000000      0.00000000
         0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000
  
  
    F  
         0.00000000      0.00000000      0.00000000
    T  
    F  
    F  
    F  
    T  
        0
         0.00000000      0.00000000      0.00000000
         0.00000000      0.00000000      0.00000000
  
  
    F  
    F  
    F  
    F  
    T  
        0
       -1     0     0     0
    F  
    F  
    F  
    F  
    F  
    F  
        2
    F  
    F  
    F  
    F  
    F  
    F  
        -2.00000000
        -2.00000000
        -1.00000000
    F  
       -1
         0.00000000
        0
        0
       -1
       -1
       -1
       60
        1
        3
        4
        0
       -30.00000000
       -30.00000000
      -200.00000000
        0
        -0.10000000
    F  
    F  
    F  
    F  
    F  
    F  
    F  
        1
        1
        1
     2800
        0
       -1
       -1
         1.00000000
  
  
         0.00000000
         0.00000000      0.00000000      0.00000000
         0.00000000
         0.00000000
         0.00000000
  
  
    F  
  
 
 
       133 
         2 
  
   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
    H    2
    H    2
    H    2
    H    2
   
  
  
   type
   atomspertype
   element
   mass
   valence
   pseudopotential
   
     129Si     28.08500000      4.00000000  PAW_PBE Si 05Jan2001                  
       4H       1.00000000      1.00000000  PAW_PBE H 15Jun2001                   
   
  
 
 
  
   
          15.36108000       0.00000000       0.00000000 
           0.00000000      15.36108000       0.00000000 
           0.00000000       0.00000000      20.86192000 
   
      4922.63661360 
   
           0.06509959       0.00000000       0.00000000 
           0.00000000       0.06509959       0.00000000 
           0.00000000       0.00000000       0.04793423 
   
  
  
          0.06325534       0.13082954       0.60327575 
          0.18765190       0.12536346       0.40531697 
          0.06265190       0.12536346       0.33952292 
          0.18957796       0.13181760       0.66992438 
          0.06261622       0.00092914       0.53881019 
          0.18765190       0.00036346       0.47034958 
          0.06265190       0.00036346       0.27368011 
          0.14018201       0.00308668       0.71798347 
          0.06325701       0.37431321       0.60715915 
          0.18765190       0.37536346       0.40531697 
          0.06265190       0.37536346       0.33952292 
          0.19361890       0.36620182       0.66967774 
          0.06272429       0.25386881       0.53583782 
          0.18765190       0.25036346       0.47034958 
          0.06265190       0.25036346       0.27368011 
          0.22935699       0.24887883       0.73863296 
          0.06139705       0.62410026       0.60468111 
          0.18765190       0.62536346       0.40531697 
          0.06265190       0.62536346       0.33952292 
          0.19152665       0.62375340       0.66626925 
          0.06252997       0.49830097       0.53890292 
          0.18765190       0.50036346       0.47034958 
          0.06265190       0.50036346       0.27368011 
          0.25692124       0.49616603       0.70199182 
          0.06161730       0.86880965       0.60030949 
          0.18765190       0.87536346       0.40531697 
          0.06265190       0.87536346       0.33952292 
          0.18591390       0.87664377       0.66654074 
          0.06276693       0.74543611       0.53488525 
          0.18765190       0.75036346       0.47034958 
          0.06265190       0.75036346       0.27368011 
          0.25627909       0.75079082       0.70313412 
          0.31162619       0.11985218       0.60127480 
          0.43765190       0.12536346       0.40531697 
          0.31265190       0.12536346       0.33952292 
          0.43916384       0.12580707       0.66518028 
          0.31240273       0.00098850       0.53245597 
          0.43765190       0.00036346       0.47034958 
          0.31265190       0.00036346       0.27368011 
          0.50023548       0.99727969       0.70526170 
          0.31336930       0.37482089       0.59663563 
          0.43765190       0.37536346       0.40531697 
          0.31265190       0.37536346       0.33952292 
          0.43399665       0.38383208       0.66846005 
          0.31218522       0.24653185       0.53551663 
          0.43765190       0.25036346       0.47034958 
          0.31265190       0.25036346       0.27368011 
          0.37458219       0.25354070       0.70405542 
          0.31611623       0.62675676       0.59603481 
          0.43765190       0.62536346       0.40531697 
          0.31265190       0.62536346       0.33952292 
          0.43148825       0.62452732       0.67026296 
          0.31294327       0.50066331       0.53290338 
          0.43765190       0.50036346       0.47034958 
          0.31265190       0.50036346       0.27368011 
          0.40100471       0.50215507       0.73716530 
          0.31336810       0.88174783       0.60137830 
          0.43765190       0.87536346       0.40531697 
          0.31265190       0.87536346       0.33952292 
          0.43599874       0.86815148       0.66903549 
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          0.43765190       0.75036346       0.47034958 
          0.31265190       0.75036346       0.27368011 
          0.40126537       0.74822344       0.73551153 
          0.56455157       0.13240389       0.59990387 
          0.68765190       0.12536346       0.40531697 
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          0.68535563       0.11966143       0.66907328 
          0.56290234       0.00054645       0.53849262 
          0.68765190       0.00036346       0.47034958 
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          0.64608346       0.99925018       0.73360305 
          0.56394722       0.37726946       0.60632524 
          0.68765190       0.37536346       0.40531697 
          0.56265190       0.37536346       0.33952292 
          0.69426012       0.38208028       0.66851729 
          0.56292803       0.25625120       0.53560167 
          0.68765190       0.25036346       0.47034958 
          0.56265190       0.25036346       0.27368011 
          0.75004850       0.24935810       0.70440186 
          0.56293428       0.62521556       0.60843318 
          0.68765190       0.62536346       0.40531697 
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          0.68765190       0.50036346       0.47034958 
          0.56265190       0.50036346       0.27368011 
          0.72703815       0.50103709       0.73697345 
          0.56325947       0.87014025       0.60242058 
          0.68765190       0.87536346       0.40531697 
          0.56265190       0.87536346       0.33952292 
          0.68699226       0.87556096       0.67120038 
          0.56249613       0.74620833       0.53638902 
          0.68765190       0.75036346       0.47034958 
          0.56265190       0.75036346       0.27368011 
          0.73153932       0.75122427       0.73359380 
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          0.93765190       0.12536346       0.40531697 
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          0.81262900       0.00102978       0.53343410 
          0.93765190       0.00036346       0.47034958 
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          0.81351427       0.37499654       0.59621745 
          0.93765190       0.37536346       0.40531697 
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          0.81293786       0.24636503       0.53580413 
          0.93765190       0.25036346       0.47034958 
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          0.81129821       0.62865210       0.59632692 
          0.93765190       0.62536346       0.40531697 
          0.81265190       0.62536346       0.33952292 
          0.93161308       0.63008841       0.66917012 
          0.81268614       0.50154289       0.53332779 
          0.93765190       0.50036346       0.47034958 
          0.81265190       0.50036346       0.27368011 
          0.87159914       0.49783277       0.70273927 
          0.81091751       0.88203934       0.60251791 
          0.93765190       0.87536346       0.40531697 
          0.81265190       0.87536346       0.33952292 
          0.93650393       0.87056254       0.66839497 
          0.81225536       0.75636188       0.53540437 
          0.93765190       0.75036346       0.47034958 
          0.81265190       0.75036346       0.27368011 
          0.88760268       0.75250041       0.73122239 
          0.70750504       0.74693574       0.84731914 
          0.75095444       0.66746752       0.87506753 
          0.61208947       0.74230239       0.86087260 
          0.90739946       0.75980971       0.80208585 
          0.74101572       0.82011924       0.88900252 
  
  
     T  T  T 
     F  F  F 
     F  F  F 
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         -3.00000000       0.00000000       0.00010000       0.00010000 
  
 
 
  
       9.53   20.82
      10.92   22.24
   
        115.70992877 
      25873.28610095 
     -38437.78593062 
      -1214.21733059 
      11376.50626006 
      -9107.00841578 
          0.00504444 
       -419.36837565 
      13344.57217335 
       1531.69945493 
       1531.69441049 
       1531.69777345 
   
  
  
      10.84   24.74
      10.84   24.75
   
       -495.97228622 
       -496.02714660 
       -495.99057302 
   
  
  
      15.75   36.65
      15.79   36.74
   
       -666.46115563 
       -666.20086151 
       -666.37439093 
   
  
  
      18.00   36.00
      18.02   36.11
   
       -675.43074012 
       -675.17778195 
       -675.34642073 
   
  
  
       9.85   25.33
      10.16   28.00
   
       -675.66583558 
       -675.41218827 
       -675.58128647 
   
  
  
       9.15   15.06
      11.06   21.45
   
       -662.61198349 
       -662.55460985 
       -662.59285894 
   
  
  
       9.40   22.05
      13.55   33.14
   
       -659.22476315 
       -659.05801969 
       -659.16918200 
   
  
  
       8.17   19.80
      10.24   25.74
   
       -658.97099170 
       -658.94510897 
       -658.96236412 
   
  
  
      12.03   26.25
      20.55   36.21
   
       -658.75863510 
       -658.68414002 
       -658.73380340 
   
  
  
      11.71   17.67
      15.97   26.54
   
       -658.77317162 
       -658.70346940 
       -658.74993755 
   
  
  
      17.43   39.91
      19.69   43.98
   
       -658.73752694 
       -658.66177156 
       -658.71227515 
   
  
  
      15.37   19.31
      16.65   22.33
   
       -658.73326196 
       -658.65033848 
       -658.70562080 
   
  
  
      10.83   25.02
      14.35   29.97
   
       -658.73107438 
       -658.64663577 
       -658.70292818 
   
  
  
      20.24   35.58
      21.97   41.60
   
       -658.73028964 
       -658.64992569 
       -658.70350166 
   
  
  
      11.15   18.31
      12.59   21.18
   
       -658.72975002 
       -658.64740981 
       -658.70230328