HMDB0061873
     RDKit          3D
3-Buten-2-one
 11 10  0  0  0  0  0  0  0  0999 V2000
    1.4842   -0.5020   -0.2676 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9959    0.6484    0.0696 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4533    0.7755    0.2298 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3679   -0.3660    0.0172 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9664    1.8807    0.5587 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8558   -1.3514   -0.4295 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5469   -0.6153   -0.3902 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6083    1.5438    0.2447 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2272   -1.0460    0.9043 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0885   -0.9705   -0.8841 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3877    0.0027   -0.0528 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  3  4  1  0
  3  5  2  0
  1  6  1  0
  1  7  1  0
  2  8  1  0
  4  9  1  0
  4 10  1  0
  4 11  1  0
M  END