MD JobServer / TaskServer

No title                                
   1.00000000000000     
     4.7372699999999996    0.0000000000000000    0.0000000000000000
     0.0000000000000000    4.7372699999999996    0.0000000000000000
     0.0000000000000000    0.0000000000000000   21.2299028599999993
   Sn   O    H 
     6    14     2
Direct
  0.4437774800000014  0.5654723199999978  0.3235839900000030
  0.4635753399999984  0.5228604099999998  0.4713751500000001
  0.9758088600000008  0.0183301599999979  0.4084553000000000
  0.0179271399999976  0.0224626199999989  0.0031764900000013
  0.5221803600000001  0.5280976900000027  0.9383186000000023
  0.5594625299999976  0.5611432600000015  0.0881387700000005
  0.6490671999999975  0.7415306400000006  0.4001157100000015
  0.1352231899999978  0.8486297399999998  0.3235587499999966
  0.1745342500000007  0.8154026599999966  0.4870640700000024
  0.7528609100000025  0.2343479399999993  0.4847536799999972
  0.7354335200000008  0.2320105699999999  0.3330909900000023
  0.2463322999999988  0.3497411199999974  0.3971783699999989
  0.7357801499999965  0.3453577100000018  0.0110806100000005
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  0.3481207900000030  0.7491513599999990  0.0111770700000022
  0.8529558800000032  0.8587765500000017  0.0878052300000007
  0.8179847999999978  0.8160634999999985  0.9249112899999972
  0.4420485600000035  0.4739671500000000  0.1806779200000008
  0.6174808000000027  0.5182219200000020  0.2331969900000033
  0.8259632999999980  0.1651986800000032  0.2937220000000025
  0.1840932899999999  0.1604527399999967  0.1221902699999973
 
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  0.00000000E+00  0.00000000E+00  0.00000000E+00