HMDB0039680
     RDKit          3D
3,5,5-Trimethyl-1,2-cyclopentanedione
 22 22  0  0  0  0  0  0  0  0999 V2000
    2.3947    0.4310    0.5683 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4687    0.0104   -0.5657 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4093   -0.8904    0.0253 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8822   -0.1633   -0.0638 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3316    0.4034    1.2850 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9507   -1.1376   -0.5115 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6730    0.9128   -1.0466 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5680    1.4929   -1.6839 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7433    1.1662   -1.1324 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2985    2.1880   -1.6041 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1006   -0.0309    1.5275 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4470    0.1583    0.3621 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3382    1.5421    0.6777 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0916   -0.5027   -1.3184 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3926   -1.8365   -0.5756 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6558   -1.1715    1.0819 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0480    1.4669    1.2922 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8725   -0.1613    2.1231 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4456    0.3227    1.3739 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7887   -0.6575   -1.0289 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3236   -1.6674    0.3882 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4564   -1.8758   -1.1744 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  4  6  1  0
  4  7  1  0
  7  8  2  0
  7  9  1  0
  9 10  2  0
  9  2  1  0
  1 11  1  0
  1 12  1  0
  1 13  1  0
  2 14  1  0
  3 15  1  0
  3 16  1  0
  5 17  1  0
  5 18  1  0
  5 19  1  0
  6 20  1  0
  6 21  1  0
  6 22  1  0
M  END