BACK15
  -OEChem-04012112163D

 18 18  0     0  0  0  0  0  0999 V2000
    4.3062   -1.4366   -0.0003 I   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5078   -0.0794   -0.0001 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0701   -0.8689    0.0004 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6415    0.6250   -1.2625 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6421    0.6254    1.2619 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6554   -1.3552   -0.0002 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.1343   -0.2351    0.0006 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3144   -0.9790    0.0003 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1885    1.1588    0.0004 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5485   -0.3288   -0.0001 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4225    1.8089    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6025    1.0651   -0.0003 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2557   -2.0649    0.0004 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6884    1.7953    0.0005 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4655    2.8942   -0.0002 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5535    1.5917   -0.0007 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7101   -1.9242    0.8542 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7096   -1.9245   -0.8546 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 10  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  2  0  0  0  0
  2  5  2  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  6 17  1  0  0  0  0
  6 18  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
  8 10  1  0  0  0  0
  8 13  1  0  0  0  0
  9 11  2  0  0  0  0
  9 14  1  0  0  0  0
 10 12  2  0  0  0  0
 11 12  1  0  0  0  0
 11 15  1  0  0  0  0
 12 16  1  0  0  0  0
M  END

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