HMDB0251369
     RDKit          3D
5,5-Dimethyl-1,3-cyclohexanedione
 22 22  0  0  0  0  0  0  0  0999 V2000
   -1.4708   -1.0520   -0.5955 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6703    0.0013    0.1832 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6425    0.6361    1.1863 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1713    0.9981   -0.8015 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2867    1.1052   -0.8978 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7654    2.1780   -1.2308 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2451    0.0032   -0.6206 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5994   -1.0213    0.2287 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0338   -2.1481    0.2911 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4127   -0.6493    1.0027 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1871   -1.0620   -1.6665 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3076   -2.0671   -0.1820 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5470   -0.7768   -0.5586 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2279    0.6668    2.1994 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5946    0.0636    1.2362 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7902    1.6858    0.8631 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5620    0.8164   -1.8361 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5904    1.9976   -0.5159 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6191   -0.4301   -1.5662 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1044    0.4312   -0.0616 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7260    0.1104    1.7694 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0309   -1.4869    1.5731 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  2  4  1  0
  4  5  1  0
  5  6  2  0
  5  7  1  0
  7  8  1  0
  8  9  2  0
  8 10  1  0
 10  2  1  0
  1 11  1  0
  1 12  1  0
  1 13  1  0
  3 14  1  0
  3 15  1  0
  3 16  1  0
  4 17  1  0
  4 18  1  0
  7 19  1  0
  7 20  1  0
 10 21  1  0
 10 22  1  0
M  END