KEGG:C02000  Alkyl sulfate
  ISISHOST03240423052D 1   1.00000     0.00000  1815
  6  5  0     0  0            999 V2000
    0.2655    0.0000    0.0000 S   0  0  3  0  0  0           0  0  0
   -0.4862    0.0000    0.0000 O   0  0  0  0  0  0           0  0  0
    1.0138    0.0000    0.0000 O   0  0  0  0  0  0           0  0  0
    0.2655    0.7517    0.0000 O   0  0  0  0  0  0           0  0  0
    0.2655   -0.7483    0.0000 O   0  0  0  0  0  0           0  0  0
   -1.3241    0.0000    0.0000 R   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
  1  5  2  0     0  0
  2  6  1  0     0  0
M  END