KEGG:C05744  Acetoacetyl-[acp]
  ISISHOST03240423132D 1   1.00000     0.00000  4857
  8  7  0     0  0            999 V2000
    0.4345    0.0000    0.0000 C   0  0  0  0  0  0           0  0  0
   -0.2828   -0.4138    0.0000 C   0  0  0  0  0  0           0  0  0
    1.1517   -0.4103    0.0000 S   0  0  0  0  0  0           0  0  0
    0.4310    0.8310    0.0000 O   0  0  0  0  0  0           0  0  0
   -0.9966   -0.0034    0.0000 C   0  0  0  0  0  0           0  0  0
    1.9759   -0.4103    0.0000 R   0  0  0  0  0  0           0  0  0
   -1.7138   -0.4207    0.0000 C   0  0  0  0  0  0           0  0  0
   -1.0035    0.8276    0.0000 O   0  0  0  0  0  0           0  0  0
  1  2  1  0     0  0
  1  3  1  0     0  0
  1  4  2  0     0  0
  2  5  1  0     0  0
  3  6  1  0     0  0
  5  7  1  0     0  0
  5  8  2  0     0  0
M  END