File: 862e31a9a3f8bf168bd30dca36541b64be95d079

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rdkit 202503.1-5
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file content (14 lines) | stat: -rw-r--r-- 476 bytes parent folder | download | duplicates (6) 
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     RDKit          2D

  5  4  0  0  0  0  0  0  0  0999 V2000
    1.2990    2.2500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5981   -0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8971    0.7500    0.0000 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