KEGG:C01887  Alkylnitrile
  ISISHOST03240423052D 1   1.00000     0.00000  1719
  3  2  0     0  0            999 V2000
    0.0724    0.0310    0.0000 C   0  0  0  0  0  0           0  0  0
    0.7621    0.3276    0.0000 N   0  0  0  0  0  0           0  0  0
   -0.8310   -0.3552    0.0000 R   0  0  0  0  0  0           0  0  0
  1  2  3  0     0  0
  1  3  1  0     0  0
M  END