KEGG:C02498  2-Ethylhexan-1-ol
  ISISHOST03240423062D 1   1.00000     0.00000  2236
  9  8  0     0  0            999 V2000
    0.5034   -0.0414    0.0000 C   0  0  3  0  0  0           0  0  0
   -0.1448    0.3345    0.0000 C   0  0  0  0  0  0           0  0  0
    0.5034   -0.7931    0.0000 C   0  0  0  0  0  0           0  0  0
    1.1552    0.3345    0.0000 C   0  0  0  0  0  0           0  0  0
   -0.7931   -0.0414    0.0000 C   0  0  0  0  0  0           0  0  0
    1.1552   -1.1655    0.0000 C   0  0  0  0  0  0           0  0  0
    1.1552    1.0828    0.0000 O   0  0  0  0  0  0           0  0  0
   -1.4448    0.3345    0.0000 C   0  0  0  0  0  0           0  0  0
   -2.0931   -0.0414    0.0000 C   0  0  0  0  0  0           0  0  0
  1  2  1  0     0  0
  1  3  1  0     0  0
  1  4  1  0     0  0
  2  5  1  0     0  0
  3  6  1  0     0  0
  4  7  1  0     0  0
  5  8  1  0     0  0
  8  9  1  0     0  0
M  END