KEGG:C02224 2-Methylcholine ISISHOST03240423062D 1 1.00000 0.00000 2012 8 7 0 0 0 999 V2000 -0.6517 0.0483 0.0000 N 0 3 3 0 0 0 0 0 0 0.0621 -0.3655 0.0000 C 0 0 0 0 0 0 0 0 0 -1.3655 -0.3655 0.0000 C 0 0 0 0 0 0 0 0 0 -0.6517 0.8724 0.0000 C 0 0 0 0 0 0 0 0 0 -0.4379 -0.7483 0.0000 C 0 0 0 0 0 0 0 0 0 0.7759 0.0483 0.0000 C 0 0 3 0 0 0 0 0 0 1.4931 -0.3655 0.0000 C 0 0 0 0 0 0 0 0 0 0.7759 0.8724 0.0000 O 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 1 5 1 0 0 0 2 6 1 0 0 0 6 7 1 0 0 0 6 8 1 0 0 0 M CHG 1 1 1 M END