File: 981560171c27431e7172df6f8eb10ff127a7d4bb

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rdkit 202209.3-1
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     RDKit          3D

  5  4  0  0  0  0  0  0  0  0999 V2000
   -1.3765    0.9720    0.4711 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4691    0.1767   -0.3415 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9439   -1.2554   -0.2952 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8683    0.2469    0.3270 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9211   -0.1402   -0.1614 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  2  4  1  0
  4  5  2  0
M  END000