B6W2QX
  -OEChem-04022108573D

 16 17  0     0  0  0  0  0  0999 V2000
   -2.4016    1.5085   -0.0131 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.7558   -0.9652   -0.0603 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4975   -2.4777    0.0393 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5373    1.7206    0.0315 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2363    1.6341    0.0045 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.4900   -0.3628   -0.0178 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8557   -0.5520    0.0026 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8675    0.8188   -0.0032 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4144   -1.2547    0.0154 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1854   -1.0641   -0.0006 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5061    1.0461    0.0125 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1272   -0.0515   -0.0107 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1159    2.6412    0.0105 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4464   -2.1147    0.0038 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2034   -0.1507   -0.0156 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8891   -1.0277   -1.0217 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  8  1  0  0  0  0
  1 12  1  0  0  0  0
  2  6  1  0  0  0  0
  2 16  1  0  0  0  0
  3  9  2  0  0  0  0
  4 11  2  0  0  0  0
  5  8  1  0  0  0  0
  5 11  1  0  0  0  0
  5 13  1  0  0  0  0
  6  9  1  0  0  0  0
  6 11  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
  7 10  1  0  0  0  0
 10 12  2  0  0  0  0
 10 14  1  0  0  0  0
 12 15  1  0  0  0  0
M  END

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