B59AEJ
  -OEChem-04022108233D

 20 21  0     0  0  0  0  0  0999 V2000
   -1.1299   -1.2085    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3927   -1.8424   -1.2737 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3942   -1.8390    1.2750 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8916    2.6290    0.0012 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7285    0.4061   -0.0028 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5182   -0.6438    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5962    0.7487   -0.0006 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7165    1.4241   -0.0011 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6347   -1.4541    0.0008 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8279    1.3800   -0.0006 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1789    0.6428    0.0010 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8796   -0.8235    0.0008 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9759    0.5805    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5585   -2.5352    0.0014 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4613    1.2185   -0.8848 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4599    1.1987    0.8997 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7343   -0.2992   -0.0096 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9139    2.4612   -0.0011 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7870   -1.4217    0.0013 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9568    1.0487    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  2  0  0  0  0
  1  5  1  0  0  0  0
  1  6  1  0  0  0  0
  4  8  2  0  0  0  0
  5  8  1  0  0  0  0
  5 11  1  0  0  0  0
  6  7  1  0  0  0  0
  6  9  2  0  0  0  0
  7  8  1  0  0  0  0
  7 10  2  0  0  0  0
  9 12  1  0  0  0  0
  9 14  1  0  0  0  0
 10 13  1  0  0  0  0
 10 18  1  0  0  0  0
 11 15  1  0  0  0  0
 11 16  1  0  0  0  0
 11 17  1  0  0  0  0
 12 13  2  0  0  0  0
 12 19  1  0  0  0  0
 13 20  1  0  0  0  0
M  END

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