KEGG:C08106 Cefoxitin sodium ISISHOST03240423192D 1 1.00000 0.00000 7149 30 31 0 0 0 999 V2000 -0.3172 0.6517 0.0000 C 0 0 1 0 0 0 0 0 0 0.4966 0.6517 0.0000 C 0 0 2 0 0 0 0 0 0 -0.3172 -0.1586 0.0000 C 0 0 0 0 0 0 0 0 0 -1.0379 1.0655 0.0000 N 0 0 0 0 0 0 0 0 0 -0.3586 1.4828 0.0000 O 0 0 0 0 0 0 0 0 0 0.4931 -0.1552 0.0000 N 0 0 3 0 0 0 0 0 0 1.2034 1.0552 0.0000 S 0 0 0 0 0 0 0 0 0 -0.8897 -0.7379 0.0000 O 0 0 0 0 0 0 0 0 0 -1.7448 0.6552 0.0000 C 0 0 0 0 0 0 0 0 0 0.3483 2.3034 0.0000 C 0 0 0 0 0 0 0 0 0 1.1931 -0.5586 0.0000 C 0 0 0 0 0 0 0 0 0 1.8966 0.6448 0.0000 C 0 0 0 0 0 0 0 0 0 -2.4552 1.0655 0.0000 C 0 0 0 0 0 0 0 0 0 -1.7483 -0.1690 0.0000 O 0 0 0 0 0 0 0 0 0 1.8897 -0.1621 0.0000 C 0 0 0 0 0 0 0 0 0 1.1897 -1.3724 0.0000 C 0 0 0 0 0 0 0 0 0 -3.1621 0.6517 0.0000 C 0 0 0 0 0 0 0 0 0 2.5966 -0.5690 0.0000 C 0 0 0 0 0 0 0 0 0 1.8966 -1.7862 0.0000 O 0 0 0 0 0 0 0 0 0 0.4759 -1.7828 0.0000 O 0 5 0 0 0 0 0 0 0 -3.3931 -0.1241 0.0000 C 0 0 0 0 0 0 0 0 0 -3.8379 1.1207 0.0000 S 0 0 0 0 0 0 0 0 0 3.2966 -0.1621 0.0000 O 0 0 0 0 0 0 0 0 0 -4.2069 -0.1448 0.0000 C 0 0 0 0 0 0 0 0 0 -4.4793 0.6207 0.0000 C 0 0 0 0 0 0 0 0 0 4.0069 -0.5586 0.0000 C 0 0 0 0 0 0 0 0 0 4.0103 -1.3724 0.0000 N 0 0 0 0 0 0 0 0 0 4.7069 -0.1552 0.0000 O 0 0 0 0 0 0 0 0 0 -1.7483 -2.0069 0.0000 Na 0 3 0 0 0 0 0 0 0 0.5414 1.5241 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 1 0 0 1 5 1 6 0 0 2 6 1 0 0 0 2 7 1 0 0 0 3 8 2 0 0 0 4 9 1 0 0 0 5 10 1 0 0 0 6 11 1 0 0 0 7 12 1 0 0 0 9 13 1 0 0 0 9 14 2 0 0 0 11 15 2 0 0 0 11 16 1 0 0 0 13 17 1 0 0 0 15 18 1 0 0 0 16 19 2 0 0 0 16 20 1 0 0 0 17 21 2 0 0 0 17 22 1 0 0 0 18 23 1 0 0 0 21 24 1 0 0 0 22 25 1 0 0 0 23 26 1 0 0 0 26 27 1 0 0 0 26 28 2 0 0 0 3 6 1 0 0 0 12 15 1 0 0 0 24 25 2 0 0 0 2 30 1 6 0 0 M CHG 2 20 -1 29 1 M END