KEGG:C07424  Pentoxifylline
  ISISHOST03240423172D 1   1.00000     0.00000  6471
 20 21  0     0  0            999 V2000
   -1.6310    0.1241    0.0000 C   0  0  0  0  0  0           0  0  0
   -1.6310   -0.7172    0.0000 C   0  0  0  0  0  0           0  0  0
   -0.9207    0.5414    0.0000 C   0  0  0  0  0  0           0  0  0
   -2.4000    0.3793    0.0000 N   0  0  3  0  0  0           0  0  0
   -0.9207   -1.1207    0.0000 N   0  0  3  0  0  0           0  0  0
   -2.4000   -0.9724    0.0000 N   0  0  0  0  0  0           0  0  0
   -0.2000    0.1069    0.0000 N   0  0  3  0  0  0           0  0  0
   -0.9207    1.3552    0.0000 O   0  0  0  0  0  0           0  0  0
   -2.8828   -0.3034    0.0000 C   0  0  0  0  0  0           0  0  0
   -2.6586    1.1621    0.0000 C   0  0  0  0  0  0           0  0  0
   -0.2000   -0.6862    0.0000 C   0  0  0  0  0  0           0  0  0
   -0.9207   -1.9655    0.0000 C   0  0  0  0  0  0           0  0  0
    0.5172    0.5138    0.0000 C   0  0  0  0  0  0           0  0  0
    0.5379   -1.1000    0.0000 O   0  0  0  0  0  0           0  0  0
    1.2276    0.1034    0.0000 C   0  0  0  0  0  0           0  0  0
    1.9414    0.5172    0.0000 C   0  0  0  0  0  0           0  0  0
    2.6517    0.1034    0.0000 C   0  0  0  0  0  0           0  0  0
    3.3655    0.5172    0.0000 C   0  0  0  0  0  0           0  0  0
    4.0793    0.1034    0.0000 C   0  0  0  0  0  0           0  0  0
    3.3655    1.3414    0.0000 O   0  0  0  0  0  0           0  0  0
  1  2  2  0     0  0
  1  3  1  0     0  0
  1  4  1  0     0  0
  2  5  1  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
  4 10  1  0     0  0
  5 11  1  0     0  0
  5 12  1  0     0  0
  7 13  1  0     0  0
 11 14  2  0     0  0
 13 15  1  0     0  0
 15 16  1  0     0  0
 16 17  1  0     0  0
 17 18  1  0     0  0
 18 19  1  0     0  0
 18 20  2  0     0  0
  6  9  2  0     0  0
  7 11  1  0     0  0
M  END