HMDB0031344
     RDKit          3D
1,2-Cyclohexanedione
 16 16  0  0  0  0  0  0  0  0999 V2000
   -1.5665    2.0541   -1.1727 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8589    1.1511   -0.6548 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4886   -0.1436   -0.2860 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6008   -0.7720    0.7694 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7678   -1.0870    0.2070 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4709    0.1958   -0.0779 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5519    1.3122   -0.3979 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0398    2.4651   -0.4461 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4865   -0.0354    0.1522 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5536   -0.7532   -1.2004 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0669   -1.6075    1.2942 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4326    0.0367    1.5378 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7122   -1.7581   -0.6608 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3098   -1.6413    1.0282 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1756    0.0879   -0.9461 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0265    0.4952    0.8539 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  2  0
  7  2  1  0
  3  9  1  0
  3 10  1  0
  4 11  1  0
  4 12  1  0
  5 13  1  0
  5 14  1  0
  6 15  1  0
  6 16  1  0
M  END