KEGG:C00726 Nitrile ISISHOST03240423022D 1 1.00000 0.00000 692 3 2 0 0 0 999 V2000 0.0000 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0.6483 0.3759 0.0000 N 0 0 0 0 0 0 0 0 0 -0.6483 -0.3759 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