BMYE30
  -OEChem-04022117273D

 21 21  0     0  0  0  0  0  0999 V2000
   -3.2184    2.5277   -0.3392 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8917   -3.2325    0.4025 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.9194   -2.2143   -0.3062 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2935   -2.2052    0.0068 N   0  3  0  0  0  0  0  0  0  0  0  0
    4.3962    0.5653   -0.9715 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.5845    1.1648    2.4347 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4072    0.1932   -0.5234 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0188   -0.9836   -0.0911 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1459    1.3735   -0.6063 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3691   -0.9802    0.2584 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4964    1.3769   -0.2568 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1079    0.2000    0.1755 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0017    0.2327   -0.8990 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9774    0.5421   -0.0475 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3116    0.5549   -0.5585 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7580    0.8846    1.3218 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6808    2.2976   -0.9437 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8837   -1.8747    0.6002 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1593    0.1898    0.4503 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2081   -0.0009   -1.9419 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1326    2.3469   -0.0602 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 11  1  0  0  0  0
  1 21  1  0  0  0  0
  2  4  1  0  0  0  0
  3  4  2  0  0  0  0
  4  8  1  0  0  0  0
  5 15  3  0  0  0  0
  6 16  3  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
  7 13  1  0  0  0  0
  8 10  1  0  0  0  0
  9 11  2  0  0  0  0
  9 17  1  0  0  0  0
 10 12  2  0  0  0  0
 10 18  1  0  0  0  0
 11 12  1  0  0  0  0
 12 19  1  0  0  0  0
 13 14  2  0  0  0  0
 13 20  1  0  0  0  0
 14 15  1  0  0  0  0
 14 16  1  0  0  0  0
M  CHG  2   2  -1   4   1
M  END

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