File: Smiles1.expected.sdf

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     RDKit          2D

  0  0  0  0  0  0  0  0  0  0999 V3000
M  V30 BEGIN CTAB
M  V30 COUNTS 9 9 0 0 0
M  V30 BEGIN ATOM
M  V30 1 N 3.750000 -1.299038 0.000000 0
M  V30 2 C 3.000000 0.000000 0.000000 0
M  V30 3 O 3.750000 1.299038 0.000000 0 CHG=-1
M  V30 4 C 1.500000 0.000000 0.000000 0
M  V30 5 C 0.750000 -1.299038 0.000000 0
M  V30 6 C -0.750000 -1.299038 0.000000 0
M  V30 7 C -1.500000 0.000000 0.000000 0 MASS=13 RAD=2 VAL=3
M  V30 8 C -0.750000 1.299038 0.000000 0
M  V30 9 C 0.750000 1.299038 0.000000 0
M  V30 END ATOM
M  V30 BEGIN BOND
M  V30 1 1 2 1 CFG=3
M  V30 2 1 2 3
M  V30 3 1 2 4
M  V30 4 2 4 5
M  V30 5 1 5 6
M  V30 6 2 6 7
M  V30 7 1 7 8
M  V30 8 2 8 9
M  V30 9 1 9 4
M  V30 END BOND
M  V30 END CTAB
M  END