KEGG:C08276  3-(Methylthio)propionic acid
  ISISHOST03240423192D 1   1.00000     0.00000  7319
  7  6  0     0  0            999 V2000
   -0.2034   -0.3552    0.0000 C   0  0  0  0  0  0           0  0  0
   -0.9172    0.0586    0.0000 C   0  0  0  0  0  0           0  0  0
    0.5103    0.0586    0.0000 C   0  0  0  0  0  0           0  0  0
   -1.6345   -0.3552    0.0000 O   0  0  0  0  0  0           0  0  0
   -0.9172    0.8828    0.0000 O   0  0  0  0  0  0           0  0  0
    1.2241   -0.3552    0.0000 S   0  0  0  0  0  0           0  0  0
    1.9379    0.0586    0.0000 C   0  0  0  0  0  0           0  0  0
  1  2  1  0     0  0
  1  3  1  0     0  0
  2  4  1  0     0  0
  2  5  2  0     0  0
  3  6  1  0     0  0
  6  7  1  0     0  0
M  END