KEGG:C03343  2-Ethylhexyl phthalate
  ISISHOST03240423082D 1   1.00000     0.00000  2931
 20 20  0     0  0            999 V2000
   -0.7414    0.5828    0.0000 C   0  0  0  0  0  0           0  0  0
   -1.4000    0.9552    0.0000 C   0  0  0  0  0  0           0  0  0
   -0.0931    0.9586    0.0000 C   0  0  0  0  0  0           0  0  0
   -0.7448   -0.1655    0.0000 C   0  0  0  0  0  0           0  0  0
   -2.0483    0.5828    0.0000 C   0  0  0  0  0  0           0  0  0
   -1.4034    1.7069    0.0000 C   0  0  0  0  0  0           0  0  0
    0.5552    0.5862    0.0000 O   0  0  0  0  0  0           0  0  0
   -0.1000    1.7069    0.0000 O   0  0  0  0  0  0           0  0  0
   -1.4000   -0.5586    0.0000 C   0  0  0  0  0  0           0  0  0
   -2.0483   -0.1759    0.0000 C   0  0  0  0  0  0           0  0  0
   -0.7517    2.0828    0.0000 O   0  0  0  0  0  0           0  0  0
   -2.0552    2.0793    0.0000 O   0  0  0  0  0  0           0  0  0
    1.2034    0.2103    0.0000 C   0  0  0  0  0  0           0  0  0
    1.2034   -0.5414    0.0000 C   0  0  3  0  0  0           0  0  0
    1.8552   -0.9172    0.0000 C   0  0  0  0  0  0           0  0  0
    0.5552   -0.9172    0.0000 C   0  0  0  0  0  0           0  0  0
    1.8552   -1.6690    0.0000 C   0  0  0  0  0  0           0  0  0
    0.5552   -1.6655    0.0000 C   0  0  0  0  0  0           0  0  0
    2.5035   -2.0414    0.0000 C   0  0  0  0  0  0           0  0  0
    2.5035   -2.7931    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  2  0     0  0
  2  5  2  0     0  0
  2  6  1  0     0  0
  3  7  1  0     0  0
  3  8  2  0     0  0
  4  9  1  0     0  0
  5 10  1  0     0  0
  6 11  1  0     0  0
  6 12  2  0     0  0
  7 13  1  0     0  0
 13 14  1  0     0  0
 14 15  1  0     0  0
 14 16  1  0     0  0
 15 17  1  0     0  0
 16 18  1  0     0  0
 17 19  1  0     0  0
 19 20  1  0     0  0
  9 10  2  0     0  0
M  END