HMDB0034466
     RDKit          3D
Acetoxyacetone
 16 15  0  0  0  0  0  0  0  0999 V2000
   -2.7131   -0.1441    0.7309 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2746    0.1811    0.5104 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5401    0.3841    1.4688 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7367    0.2582   -0.8629 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6188    0.5717   -0.8599 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5745   -0.2166   -0.2459 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0184    0.0810   -0.2206 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1765   -1.2581    0.3289 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9870    0.0673    1.7905 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2951    0.5336    0.0659 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9670   -1.1803    0.4409 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8687   -0.7249   -1.3698 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2872    0.9921   -1.4900 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2886    0.9469   -0.8473 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6062   -0.8175   -0.5673 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3866    0.3256    0.8134 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  6  8  2  0
  1  9  1  0
  1 10  1  0
  1 11  1  0
  4 12  1  0
  4 13  1  0
  7 14  1  0
  7 15  1  0
  7 16  1  0
M  END