KEGG:C05557 Isopenicillin N ISISHOST03240423122D 1 1.00000 0.00000 4707 26 27 0 1 0 999 V2000 1.4586 -0.3379 0.0000 N 0 0 3 0 0 0 0 0 0 1.4552 0.4586 0.0000 C 0 0 1 0 0 0 0 0 0 2.8345 -0.3414 0.0000 C 0 0 2 0 0 0 0 0 0 0.6655 -0.3379 0.0000 C 0 0 0 0 0 0 0 0 0 0.6621 0.4552 0.0000 C 0 0 1 0 0 0 0 0 0 2.1414 0.8586 0.0000 S 0 0 0 0 0 0 0 0 0 2.8379 0.4552 0.0000 C 0 0 3 0 0 0 0 0 0 3.4103 -0.9138 0.0000 C 0 0 0 0 0 0 0 0 0 0.0931 -0.8966 0.0000 O 0 0 0 0 0 0 0 0 0 -0.1379 0.4621 0.0000 N 0 0 0 0 0 0 0 0 0 3.6000 0.2517 0.0000 C 0 0 0 0 0 0 0 0 0 3.3931 1.0241 0.0000 C 0 0 0 0 0 0 0 0 0 2.9966 -1.6207 0.0000 O 0 0 0 0 0 0 0 0 0 4.2241 -0.9138 0.0000 O 0 0 0 0 0 0 0 0 0 -0.8448 0.0586 0.0000 C 0 0 0 0 0 0 0 0 0 -1.5517 0.4655 0.0000 C 0 0 0 0 0 0 0 0 0 -0.8483 -0.7586 0.0000 O 0 0 0 0 0 0 0 0 0 -2.2586 0.0586 0.0000 C 0 0 0 0 0 0 0 0 0 -2.9621 0.4655 0.0000 C 0 0 0 0 0 0 0 0 0 -3.6690 0.0586 0.0000 C 0 0 1 0 0 0 0 0 0 -4.3759 0.4655 0.0000 C 0 0 0 0 0 0 0 0 0 -3.6759 -0.7586 0.0000 N 0 0 0 0 0 0 0 0 0 -5.0828 0.0621 0.0000 O 0 0 0 0 0 0 0 0 0 -4.3724 1.2828 0.0000 O 0 0 0 0 0 0 0 0 0 1.4517 1.2517 0.0000 H 0 0 0 0 0 0 0 0 0 0.6552 1.2517 0.0000 H 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 1 0 0 0 2 6 1 1 0 0 3 7 1 0 0 0 3 8 1 6 0 0 4 9 2 0 0 0 5 10 1 1 0 0 7 11 1 0 0 0 7 12 1 0 0 0 8 13 1 0 0 0 8 14 2 0 0 0 10 15 1 0 0 0 15 16 1 0 0 0 15 17 2 0 0 0 16 18 1 0 0 0 18 19 1 0 0 0 19 20 1 0 0 0 20 21 1 0 0 0 20 22 1 6 0 0 21 23 1 0 0 0 21 24 2 0 0 0 4 5 1 0 0 0 6 7 1 0 0 0 2 25 1 6 0 0 5 26 1 6 0 0 M END