KEGG:C02420  Isobutyronitrile
  ISISHOST03240423062D 1   1.00000     0.00000  2177
  5  4  0     0  0            999 V2000
   -0.2621   -0.1483    0.0000 C   0  0  3  0  0  0           0  0  0
    0.3897    0.2241    0.0000 C   0  0  0  0  0  0           0  0  0
   -0.9103    0.2276    0.0000 C   0  0  0  0  0  0           0  0  0
   -0.2621   -0.9000    0.0000 C   0  0  0  0  0  0           0  0  0
    1.0414    0.5966    0.0000 N   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  3  0     0  0
M  END