KEGG:C01769  (S)-Acetoin
  ISISHOST03240423052D 1   1.00000     0.00000  1617
  6  5  0     1  0            999 V2000
    0.2931   -0.2931    0.0000 C   0  0  2  0  0  0           0  0  0
   -0.2931    0.2931    0.0000 C   0  0  0  0  0  0           0  0  0
    0.8724    0.2966    0.0000 C   0  0  0  0  0  0           0  0  0
    0.2931   -1.1172    0.0000 O   0  0  0  0  0  0           0  0  0
   -0.8724   -0.2966    0.0000 C   0  0  0  0  0  0           0  0  0
   -0.2931    1.1172    0.0000 O   0  0  0  0  0  0           0  0  0
  1  2  1  0     0  0
  1  3  1  1     0  0
  1  4  1  6     0  0
  2  5  1  0     0  0
  2  6  2  0     0  0
M  END