MD JobServer / TaskServer

No title                                
   1.00000000000000     
    15.0000000000000000    0.0000000000000000    0.0000000000000000
     0.0000000000000000   10.0000000000000000    0.0000000000000000
     0.0000000000000000    0.0000000000000000   10.0000000000000000
   Si   C    N    O    H 
     2     8     2     3    24
Direct
  0.3146041600000018  0.5270818799999972  0.5331119599999994
  0.4816023099999995  0.5867269000000022  0.5108544799999990
  0.4180616200000031  0.4723639400000010  0.6271943599999972
  0.3806518499999996  0.6180954800000009  0.4005628999999971
  0.4762069599999990  0.8080664800000008  0.6712326999999974
  0.2154053499999975  0.6271394999999984  0.7381779399999999
  0.5924743799999987  0.1013273800000007  0.4230953000000000
  0.6266276400000024  0.1821199299999989  0.6460304399999970
  0.2393543100000031  0.2706880699999985  0.5521293199999988
  0.1873234800000034  0.4111564199999975  0.3690998699999994
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  0.2891621999999998  0.2634118499999971  0.6324256300000002
  0.2490285200000031  0.1843156899999983  0.4844250100000025
  0.1724170600000008  0.2603587300000001  0.5979290599999985
  0.1950357500000024  0.3284578800000020  0.2963870399999990
  0.1999278099999984  0.5054843899999995  0.3155879799999965
  0.1168200299999995  0.4117813100000021  0.4023113599999988
  0.5939697499999994  0.5467424899999997  0.3617987200000030
  0.5774602500000015  0.2927640600000032  0.4911136099999993
 
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