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 
   
  
  
          0.06319800       0.13098117       0.60351070 
          0.18765881       0.12537998       0.40545344 
          0.06265881       0.12537998       0.33965939 
          0.18952587       0.13152908       0.67013643 
          0.06262102       0.00098143       0.53901411 
          0.18765881       0.00037998       0.47048605 
          0.06265881       0.00037998       0.27381658 
          0.14073850       0.00300694       0.71914332 
          0.06313129       0.37427374       0.60743928 
          0.18765881       0.37537998       0.40545344 
          0.06265881       0.37537998       0.33965939 
          0.19361808       0.36619887       0.66983653 
          0.06271644       0.25391092       0.53600271 
          0.18765881       0.25037998       0.47048605 
          0.06265881       0.25037998       0.27381658 
          0.22935907       0.24882981       0.73872223 
          0.06142785       0.62407307       0.60478245 
          0.18765881       0.62537998       0.40545344 
          0.06265881       0.62537998       0.33965939 
          0.19150940       0.62382467       0.66644597 
          0.06252501       0.49827638       0.53911341 
          0.18765881       0.50037998       0.47048605 
          0.06265881       0.50037998       0.27381658 
          0.25689198       0.49620993       0.70211545 
          0.06167459       0.86874782       0.60038022 
          0.18765881       0.87537998       0.40545344 
          0.06265881       0.87537998       0.33965939 
          0.18583688       0.87689219       0.66677312 
          0.06276978       0.74539045       0.53501446 
          0.18765881       0.75037998       0.47048605 
          0.06265881       0.75037998       0.27381658 
          0.25620869       0.75091812       0.70333258 
          0.31165130       0.11990437       0.60148913 
          0.43765881       0.12537998       0.40545344 
          0.31265881       0.12537998       0.33965939 
          0.43926178       0.12592657       0.66537165 
          0.31241965       0.00101725       0.53264928 
          0.43765881       0.00037998       0.47048605 
          0.31265881       0.00037998       0.27381658 
          0.50023901       0.99735128       0.70540228 
          0.31342476       0.37486902       0.59681554 
          0.43765881       0.37537998       0.40545344 
          0.31265881       0.37537998       0.33965939 
          0.43407030       0.38386080       0.66863451 
          0.31219772       0.24656687       0.53569083 
          0.43765881       0.25037998       0.47048605 
          0.31265881       0.25037998       0.27381658 
          0.37458529       0.25361204       0.70426662 
          0.31615959       0.62681437       0.59622052 
          0.43765881       0.62537998       0.40545344 
          0.31265881       0.62537998       0.33965939 
          0.43157663       0.62462201       0.67044630 
          0.31295889       0.50072061       0.53307162 
          0.43765881       0.50037998       0.47048605 
          0.31265881       0.50037998       0.27381658 
          0.40097745       0.50221586       0.73726831 
          0.31337250       0.88175455       0.60160375 
          0.43765881       0.87537998       0.40545344 
          0.31265881       0.87537998       0.33965939 
          0.43604985       0.86815761       0.66927344 
          0.31289093       0.75497732       0.53558310 
          0.43765881       0.75037998       0.47048605 
          0.31265881       0.75037998       0.27381658 
          0.40123485       0.74824209       0.73573841 
          0.56465676       0.13251193       0.60011241 
          0.68765881       0.12537998       0.40545344 
          0.56265881       0.12537998       0.33965939 
          0.68562022       0.12002457       0.66919216 
          0.56295595       0.00058922       0.53872099 
          0.68765881       0.00037998       0.47048605 
          0.56265881       0.00037998       0.27381658 
          0.64618666       0.99922988       0.73331426 
          0.56407872       0.37728390       0.60654010 
          0.68765881       0.37537998       0.40545344 
          0.56265881       0.37537998       0.33965939 
          0.69443601       0.38192014       0.66876496 
          0.56295041       0.25631551       0.53577323 
          0.68765881       0.25037998       0.47048605 
          0.56265881       0.25037998       0.27381658 
          0.75090639       0.24945278       0.70478897 
          0.56305101       0.62528326       0.60860891 
          0.68765881       0.62537998       0.40545344 
          0.56265881       0.62537998       0.33965939 
          0.69560827       0.62340404       0.67005389 
          0.56266834       0.50188991       0.53924592 
          0.68765881       0.50037998       0.47048605 
          0.56265881       0.50037998       0.27381658 
          0.72734883       0.50114007       0.73698360 
          0.56330238       0.87016273       0.60264745 
          0.68765881       0.87537998       0.40545344 
          0.56265881       0.87537998       0.33965939 
          0.68712498       0.87550818       0.67108135 
          0.56252095       0.74625237       0.53656381 
          0.68765881       0.75037998       0.47048605 
          0.56265881       0.75037998       0.27381658 
          0.73173571       0.75072157       0.73169795 
          0.81299104       0.12035198       0.60273023 
          0.93765881       0.12537998       0.40545344 
          0.81265881       0.12537998       0.33965939 
          0.93621920       0.13308863       0.66997486 
          0.81264235       0.00117789       0.53356269 
          0.93765881       0.00037998       0.47048605 
          0.81265881       0.00037998       0.27381658 
          0.99269500       0.00127937       0.70800207 
          0.81372424       0.37512306       0.59649171 
          0.93765881       0.37537998       0.40545344 
          0.81265881       0.37537998       0.33965939 
          0.93269170       0.36674286       0.66977300 
          0.81293879       0.24658279       0.53592767 
          0.93765881       0.25037998       0.47048605 
          0.81265881       0.25037998       0.27381658 
          0.89659557       0.24951225       0.73925810 
          0.81131833       0.62839800       0.59620763 
          0.93765881       0.62537998       0.40545344 
          0.81265881       0.62537998       0.33965939 
          0.93179826       0.62937793       0.66851096 
          0.81269921       0.50153043       0.53345337 
          0.93765881       0.50037998       0.47048605 
          0.81265881       0.50037998       0.27381658 
          0.87192939       0.49776141       0.70300739 
          0.81088570       0.88209015       0.60242194 
          0.93765881       0.87537998       0.40545344 
          0.81265881       0.87537998       0.33965939 
          0.93653021       0.87065899       0.66790457 
          0.81224488       0.75628837       0.53550110 
          0.93765881       0.75037998       0.47048605 
          0.81265881       0.75037998       0.27381658 
          0.88795577       0.75157549       0.72969489 
          0.70423676       0.74641598       0.84400954 
          0.74747315       0.66768845       0.87235153 
          0.60869070       0.74197031       0.85710416 
          0.91306522       0.75622153       0.79997965 
          0.73877200       0.82233050       0.88194170 
  
 
 
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          8 
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        129 
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        132 
        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 
   
  
  
          0.06319800       0.13098117       0.60351070 
          0.18765881       0.12537998       0.40545344 
          0.06265881       0.12537998       0.33965939 
          0.18952587       0.13152908       0.67013643 
          0.06262102       0.00098143       0.53901411 
          0.18765881       0.00037998       0.47048605 
          0.06265881       0.00037998       0.27381658 
          0.14073850       0.00300694       0.71914332 
          0.06313129       0.37427374       0.60743928 
          0.18765881       0.37537998       0.40545344 
          0.06265881       0.37537998       0.33965939 
          0.19361808       0.36619887       0.66983653 
          0.06271644       0.25391092       0.53600271 
          0.18765881       0.25037998       0.47048605 
          0.06265881       0.25037998       0.27381658 
          0.22935907       0.24882981       0.73872223 
          0.06142785       0.62407307       0.60478245 
          0.18765881       0.62537998       0.40545344 
          0.06265881       0.62537998       0.33965939 
          0.19150940       0.62382467       0.66644597 
          0.06252501       0.49827638       0.53911341 
          0.18765881       0.50037998       0.47048605 
          0.06265881       0.50037998       0.27381658 
          0.25689198       0.49620993       0.70211545 
          0.06167459       0.86874782       0.60038022 
          0.18765881       0.87537998       0.40545344 
          0.06265881       0.87537998       0.33965939 
          0.18583688       0.87689219       0.66677312 
          0.06276978       0.74539045       0.53501446 
          0.18765881       0.75037998       0.47048605 
          0.06265881       0.75037998       0.27381658 
          0.25620869       0.75091812       0.70333258 
          0.31165130       0.11990437       0.60148913 
          0.43765881       0.12537998       0.40545344 
          0.31265881       0.12537998       0.33965939 
          0.43926178       0.12592657       0.66537165 
          0.31241965       0.00101725       0.53264928 
          0.43765881       0.00037998       0.47048605 
          0.31265881       0.00037998       0.27381658 
          0.50023901       0.99735128       0.70540228 
          0.31342476       0.37486902       0.59681554 
          0.43765881       0.37537998       0.40545344 
          0.31265881       0.37537998       0.33965939 
          0.43407030       0.38386080       0.66863451 
          0.31219772       0.24656687       0.53569083 
          0.43765881       0.25037998       0.47048605 
          0.31265881       0.25037998       0.27381658 
          0.37458529       0.25361204       0.70426662 
          0.31615959       0.62681437       0.59622052 
          0.43765881       0.62537998       0.40545344 
          0.31265881       0.62537998       0.33965939 
          0.43157663       0.62462201       0.67044630 
          0.31295889       0.50072061       0.53307162 
          0.43765881       0.50037998       0.47048605 
          0.31265881       0.50037998       0.27381658 
          0.40097745       0.50221586       0.73726831 
          0.31337250       0.88175455       0.60160375 
          0.43765881       0.87537998       0.40545344 
          0.31265881       0.87537998       0.33965939 
          0.43604985       0.86815761       0.66927344 
          0.31289093       0.75497732       0.53558310 
          0.43765881       0.75037998       0.47048605 
          0.31265881       0.75037998       0.27381658 
          0.40123485       0.74824209       0.73573841 
          0.56465676       0.13251193       0.60011241 
          0.68765881       0.12537998       0.40545344 
          0.56265881       0.12537998       0.33965939 
          0.68562022       0.12002457       0.66919216 
          0.56295595       0.00058922       0.53872099 
          0.68765881       0.00037998       0.47048605 
          0.56265881       0.00037998       0.27381658 
          0.64618666       0.99922988       0.73331426 
          0.56407872       0.37728390       0.60654010 
          0.68765881       0.37537998       0.40545344 
          0.56265881       0.37537998       0.33965939 
          0.69443601       0.38192014       0.66876496 
          0.56295041       0.25631551       0.53577323 
          0.68765881       0.25037998       0.47048605 
          0.56265881       0.25037998       0.27381658 
          0.75090639       0.24945278       0.70478897 
          0.56305101       0.62528326       0.60860891 
          0.68765881       0.62537998       0.40545344 
          0.56265881       0.62537998       0.33965939 
          0.69560827       0.62340404       0.67005389 
          0.56266834       0.50188991       0.53924592 
          0.68765881       0.50037998       0.47048605 
          0.56265881       0.50037998       0.27381658 
          0.72734883       0.50114007       0.73698360 
          0.56330238       0.87016273       0.60264745 
          0.68765881       0.87537998       0.40545344 
          0.56265881       0.87537998       0.33965939 
          0.68712498       0.87550818       0.67108135 
          0.56252095       0.74625237       0.53656381 
          0.68765881       0.75037998       0.47048605 
          0.56265881       0.75037998       0.27381658 
          0.73173571       0.75072157       0.73169795 
          0.81299104       0.12035198       0.60273023 
          0.93765881       0.12537998       0.40545344 
          0.81265881       0.12537998       0.33965939 
          0.93621920       0.13308863       0.66997486 
          0.81264235       0.00117789       0.53356269 
          0.93765881       0.00037998       0.47048605 
          0.81265881       0.00037998       0.27381658 
          0.99269500       0.00127937       0.70800207 
          0.81372424       0.37512306       0.59649171 
          0.93765881       0.37537998       0.40545344 
          0.81265881       0.37537998       0.33965939 
          0.93269170       0.36674286       0.66977300 
          0.81293879       0.24658279       0.53592767 
          0.93765881       0.25037998       0.47048605 
          0.81265881       0.25037998       0.27381658 
          0.89659557       0.24951225       0.73925810 
          0.81131833       0.62839800       0.59620763 
          0.93765881       0.62537998       0.40545344 
          0.81265881       0.62537998       0.33965939 
          0.93179826       0.62937793       0.66851096 
          0.81269921       0.50153043       0.53345337 
          0.93765881       0.50037998       0.47048605 
          0.81265881       0.50037998       0.27381658 
          0.87192939       0.49776141       0.70300739 
          0.81088570       0.88209015       0.60242194 
          0.93765881       0.87537998       0.40545344 
          0.81265881       0.87537998       0.33965939 
          0.93653021       0.87065899       0.66790457 
          0.81224488       0.75628837       0.53550110 
          0.93765881       0.75037998       0.47048605 
          0.81265881       0.75037998       0.27381658 
          0.88795577       0.75157549       0.72969489 
          0.70423676       0.74641598       0.84400954 
          0.74747315       0.66768845       0.87235153 
          0.60869070       0.74197031       0.85710416 
          0.91306522       0.75622153       0.79997965 
          0.73877200       0.82233050       0.88194170 
  
  
     T  T  T 
     F  F  F 
     F  F  F 
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         -3.00000000       0.00000000       0.00010000       0.00010000 
  
 
 
  
      14.35   35.31
      16.07   37.77
   
        115.70992877 
      25927.96244014 
     -38491.46145662 
      -1214.11383973 
      11376.50626006 
      -9107.00841578 
          0.01005465 
       -419.51497961 
      13344.57217335 
       1532.66216523 
       1532.65211058 
       1532.65881368 
   
  
  
      12.20   34.44
      12.28   34.65
   
       -495.99914448 
       -496.05124342 
       -496.01651080 
   
  
  
       9.45   25.90
       9.47   25.95
   
       -666.69594873 
       -666.43431649 
       -666.60873798 
   
  
  
      16.65   26.11
      16.65   26.13
   
       -675.55500676 
       -675.30076091 
       -675.47025814 
   
  
  
       7.66   23.59
       7.93   27.43
   
       -675.79212933 
       -675.53736649 
       -675.70720838 
   
  
  
      17.46   23.46
      21.72   28.89
   
       -662.75034217 
       -662.69527161 
       -662.73198531 
   
  
  
      13.31   24.62
      15.17   31.64
   
       -659.37186901 
       -659.19562289 
       -659.31312030 
   
  
  
      17.17   23.73
      18.36   29.73
   
       -659.09280868 
       -659.06638864 
       -659.08400200 
   
  
  
      21.05   29.85
      23.18   36.25
   
       -658.88441238 
       -658.80622039 
       -658.85834838 
   
  
  
      10.58   19.78
      13.44   25.75
   
       -658.90510977 
       -658.83484460 
       -658.88168804 
   
  
  
      11.94   20.74
      19.91   39.23
   
       -658.86760217 
       -658.79119278 
       -658.84213237 
   
  
  
      14.32   20.83
      15.66   23.92
   
       -658.86358811 
       -658.77905710 
       -658.83541111 
   
  
  
      13.88   28.41
      15.71   33.81
   
       -658.86165432 
       -658.77597650 
       -658.83309505 
   
  
  
       8.58   14.61
      15.74   34.00
   
       -658.86075517 
       -658.77955762 
       -658.83368932