BC1B5N
  -OEChem-04022109093D

 19 19  0     0  0  0  0  0  0999 V2000
   -2.7757    2.2248   -0.0069 Br  0  0  0  0  0  0  0  0  0  0  0  0
    2.3627    0.1453    0.1033 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.5991    1.4590    0.6853 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0077   -1.0271    0.6778 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7250    0.2082   -1.5653 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5003   -0.8489   -0.0441 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.6398   -0.1355    0.0591 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2431    0.9443    0.0454 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1464   -1.4400    0.0387 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1126   -0.5849   -0.0092 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6193    0.7196    0.0113 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2297   -1.6648    0.0046 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1383    1.9625    0.0545 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8158   -2.2957    0.0425 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6000   -2.6868   -0.0124 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9717    1.1216   -1.9655 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2489   -0.5777   -1.9694 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1569   -0.0796   -0.0540 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8369   -1.8024   -0.0578 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 11  1  0  0  0  0
  2  3  2  0  0  0  0
  2  4  2  0  0  0  0
  2  5  1  0  0  0  0
  2  7  1  0  0  0  0
  5 16  1  0  0  0  0
  5 17  1  0  0  0  0
  6 10  1  0  0  0  0
  6 18  1  0  0  0  0
  6 19  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
  8 11  1  0  0  0  0
  8 13  1  0  0  0  0
  9 12  2  0  0  0  0
  9 14  1  0  0  0  0
 10 11  2  0  0  0  0
 10 12  1  0  0  0  0
 12 15  1  0  0  0  0
M  END

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