File: aceticacid.mol

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file content (20 lines) | stat: -rw-r--r-- 723 bytes parent folder | download | duplicates (4) 
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     RDKit          3D

  8  7  0  0  0  0  0  0  0  0999 V2000
   -0.9507   -0.1350   -0.0788 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4609    0.2321    0.2395 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3451   -0.3758   -0.5728 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8335    0.9884    1.1196 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6234    0.3853    0.6088 H   0  0  0  0  0  1  0  0  0  0  0  0
   -1.0902   -1.2118    0.0442 H   0  0  0  0  0  1  0  0  0  0  0  0
   -1.1914    0.1699   -1.1002 H   0  0  0  0  0  1  0  0  0  0  0  0
    2.2163   -0.0531   -0.2603 H   0  0  0  0  0  1  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  2  4  2  0
  1  5  1  0
  1  6  1  0
  1  7  1  0
  3  8  1  0
M  END