MD JobServer / TaskServer

No title                                
   1.00000000000000     
    20.0000000000000000    0.0000000000000000    0.0000000000000000
     0.0000000000000000   15.0000000000000000    0.0000000000000000
     0.0000000000000000    0.0000000000000000   15.0000000000000000
   N    H    C    Si   O 
     1    22     7     2     4
Direct
  0.6539878700000017  0.4632947999999999  0.5934388599999991
  0.6776543200000020  0.4569054999999977  0.6542077200000023
  0.6905472799999970  0.4486271199999976  0.5483877300000017
  0.1531804600000015  0.5164370000000034  0.3679514299999980
  0.2102485999999999  0.6085649999999987  0.3668697600000002
  0.2226400500000025  0.5167214100000024  0.2930792000000011
  0.1129745100000008  0.5467283600000030  0.6574387300000026
  0.1519286699999967  0.6354675799999967  0.5976524000000012
  0.1088825499999970  0.5488419200000010  0.5386369699999989
  0.4215038299999989  0.4283665399999990  0.2949079799999978
  0.4210639300000025  0.3380864399999979  0.3725760000000022
  0.3481554900000035  0.4071927000000031  0.3600708600000004
  0.5399226299999995  0.2777051200000002  0.5757910000000024
  0.5388808800000007  0.3536743900000019  0.4770102900000026
  0.6112111899999988  0.4207678799999996  0.5866085400000003
  0.2491824900000026  0.6880154999999988  0.5044753199999974
  0.3072829600000020  0.6655359199999964  0.5907627899999994
  0.3317646400000029  0.6544659600000031  0.4771249900000001
  0.4432831800000017  0.6202881500000004  0.5588258000000010
  0.4529425599999968  0.5560492099999976  0.6584454799999975
  0.5157105799999968  0.5521309399999978  0.5746897000000004
  0.3273094799999967  0.4436312400000020  0.6413187799999989
  0.3126583600000004  0.3761860600000020  0.5472506400000015
  0.3301625499999972  0.4429465899999983  0.5678338499999995
  0.2062219700000014  0.5354028799999995  0.3605963099999983
  0.1411464299999992  0.5632365499999992  0.5966304700000009
  0.4032792599999979  0.4066649199999972  0.3606003000000015
  0.5243709900000013  0.3411956400000022  0.5463197400000013
  0.2904736200000002  0.6436952199999979  0.5243926699999975
  0.4614114900000033  0.5568127000000018  0.5859345399999967
  0.4198608800000017  0.4589030500000035  0.5348881000000034
  0.2651614500000008  0.5232032999999987  0.5265175400000004
  0.2468866800000029  0.4895751500000003  0.4236252199999981
  0.2005804900000001  0.5109333799999973  0.5954079899999982
  0.4291649899999967  0.4670657500000033  0.4257096500000017
  0.4626187000000002  0.3690070000000034  0.5739322800000011
 
  0.00000000E+00  0.00000000E+00  0.00000000E+00
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  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
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  0.00000000E+00  0.00000000E+00  0.00000000E+00
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  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00