BI58WQ
  -OEChem-04012114303D

 19 19  0     0  0  0  0  0  0999 V2000
   -2.2551    2.5072   -0.0008 S   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4288   -1.7808    0.0010 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2324   -2.3252    0.0008 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2689    1.6383    0.0020 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2292   -0.0142    0.0022 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7858   -1.7854   -0.0034 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6554   -0.0882   -0.0005 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5506    0.5849   -0.0006 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8371   -0.0276    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6324    1.9600   -0.0012 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8530    0.9026    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1009   -1.4440    0.0007 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9324    0.4654   -0.0001 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0187   -0.5930   -0.0002 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1505    2.7028   -0.0019 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5847   -1.1028   -0.0008 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9219    0.7390    0.0004 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5556   -2.7537    0.0014 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9557   -0.6733    0.0016 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 10  1  0  0  0  0
  1 11  1  0  0  0  0
  2 12  1  0  0  0  0
  2 18  1  0  0  0  0
  3 12  2  0  0  0  0
  4 13  2  0  0  0  0
  5 14  1  0  0  0  0
  5 19  1  0  0  0  0
  6 14  2  0  0  0  0
  7  8  1  0  0  0  0
  7 13  1  0  0  0  0
  7 16  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  2  0  0  0  0
  9 11  2  0  0  0  0
  9 12  1  0  0  0  0
 10 15  1  0  0  0  0
 11 17  1  0  0  0  0
 13 14  1  0  0  0  0
M  END

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