L9R4EK
  -OEChem-05022322393D

 22 23  0     0  0  0  0  0  0999 V2000
    3.2722    0.4557   -0.0991 S   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3050   -1.2339    0.0271 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2893    1.7873   -0.6862 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1018   -0.5973   -0.6659 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9112    1.2923   -0.0135 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9506    1.0044   -0.0119 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6094    0.5842    1.5705 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1777    0.0965    0.0411 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.6170   -0.1075   -0.0604 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7434    0.3487   -0.0241 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9563   -1.0217   -0.0003 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5734    0.8295   -0.0550 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3579   -1.4834   -0.0357 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0503   -1.9795   -0.0047 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8270    0.0246    0.0182 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7612    1.8978   -0.0676 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1749   -2.2013   -0.0327 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1609   -3.0413    0.0163 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2536   -0.1026    1.9812 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6988    1.5273    1.9678 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7539   -0.7397    0.0636 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3943    1.2598    0.8297 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  3  2  0  0  0  0
  1  4  2  0  0  0  0
  1  7  1  0  0  0  0
  1  9  1  0  0  0  0
  2 11  1  0  0  0  0
  2 15  1  0  0  0  0
  5  8  1  0  0  0  0
  5 22  1  0  0  0  0
  6 10  1  0  0  0  0
  6 15  2  0  0  0  0
  7 19  1  0  0  0  0
  7 20  1  0  0  0  0
  8 15  1  0  0  0  0
  8 21  1  0  0  0  0
  9 12  2  0  0  0  0
  9 13  1  0  0  0  0
 10 11  2  0  0  0  0
 10 12  1  0  0  0  0
 11 14  1  0  0  0  0
 12 16  1  0  0  0  0
 13 14  2  0  0  0  0
 13 17  1  0  0  0  0
 14 18  1  0  0  0  0
M  END

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