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
  0.6635112599999999  0.4793732199999994  0.5952545000000029
  0.6830520500000006  0.4577912600000005  0.6557102700000002
  0.6950152000000003  0.4486663899999996  0.5495617400000015
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  0.2226770400000007  0.5167058999999981  0.2931695500000018
  0.1134990799999969  0.5464586200000028  0.6573322300000015
  0.1522981399999992  0.6351997699999998  0.5976470399999982
  0.1092981399999999  0.5485781000000003  0.5385995199999982
  0.4215726899999979  0.4284576100000024  0.2953581399999976
  0.4210005600000031  0.3377142699999993  0.3724642800000026
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  0.4528376199999968  0.5573696200000029  0.6582420100000022
  0.5157462800000019  0.5541835399999968  0.5748897599999978
  0.3279698899999985  0.4430122099999991  0.6414581299999966
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  0.2907301899999979  0.6434152100000006  0.5243431600000008
  0.4614239400000031  0.5590001400000020  0.5857794699999985
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  0.2657073000000025  0.5227777300000014  0.5265401600000033
  0.2473964100000003  0.4893662100000000  0.4235474999999980
  0.2011071700000002  0.5106041900000022  0.5953044500000004
  0.4298642700000030  0.4665649700000003  0.4259965600000015
  0.4650153199999991  0.3699338600000033  0.5745350099999982
 
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  0.00000000E+00  0.00000000E+00  0.00000000E+00