KEGG:C05466 Glycochenodeoxycholate ISISHOST03240423122D 1 1.00000 0.00000 4637 33 36 0 0 0 999 V2000 -0.2276 -0.6310 0.0000 C 0 0 3 0 0 0 0 0 0 -0.9345 -1.0345 0.0000 C 0 0 3 0 0 0 0 0 0 -0.2172 0.1759 0.0000 C 0 0 1 0 0 0 0 0 0 1.1724 -0.6483 0.0000 C 0 0 0 0 0 0 0 0 0 -1.6310 -0.6207 0.0000 C 0 0 3 0 0 0 0 0 0 -0.9345 -1.8448 0.0000 C 0 0 1 0 0 0 0 0 0 0.4862 0.5759 0.0000 C 0 0 3 0 0 0 0 0 0 -0.9207 0.5897 0.0000 C 0 0 0 0 0 0 0 0 0 -0.2241 0.9897 0.0000 C 0 0 0 0 0 0 0 0 0 1.1759 0.1586 0.0000 C 0 0 0 0 0 0 0 0 0 -2.3379 -1.0276 0.0000 C 0 0 2 0 0 0 0 0 0 -1.6241 0.1897 0.0000 C 0 0 0 0 0 0 0 0 0 -1.6379 -2.2448 0.0000 C 0 0 0 0 0 0 0 0 0 -0.2276 -2.2517 0.0000 O 0 0 0 0 0 0 0 0 0 0.4931 1.3862 0.0000 C 0 0 3 0 0 0 0 0 0 -2.3414 -1.8379 0.0000 C 0 0 2 0 0 0 0 0 0 -3.0379 -0.6172 0.0000 C 0 0 0 0 0 0 0 0 0 -2.3448 -0.2138 0.0000 C 0 0 0 0 0 0 0 0 0 1.2000 1.7828 0.0000 C 0 0 0 0 0 0 0 0 0 -0.2034 1.8000 0.0000 C 0 0 0 0 0 0 0 0 0 -3.0379 -2.2448 0.0000 C 0 0 0 0 0 0 0 0 0 -3.7448 -1.0276 0.0000 C 0 0 0 0 0 0 0 0 0 1.9069 1.3828 0.0000 C 0 0 0 0 0 0 0 0 0 -3.7448 -1.8379 0.0000 C 0 0 1 0 0 0 0 0 0 2.6069 1.7862 0.0000 C 0 0 0 0 0 0 0 0 0 -4.4448 -2.2448 0.0000 O 0 0 0 0 0 0 0 0 0 3.3103 1.3828 0.0000 N 0 0 0 0 0 0 0 0 0 2.6069 2.6000 0.0000 O 0 0 0 0 0 0 0 0 0 4.0103 1.7862 0.0000 C 0 0 0 0 0 0 0 0 0 4.7138 1.3828 0.0000 C 0 0 0 0 0 0 0 0 0 5.4138 1.7897 0.0000 O 0 0 0 0 0 0 0 0 0 4.7138 0.5690 0.0000 O 0 0 0 0 0 0 0 0 0 -2.3483 -2.6483 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 0 0 0 3 7 1 0 0 0 3 8 1 0 0 0 3 9 1 1 0 0 4 10 1 0 0 0 5 11 1 0 0 0 5 12 1 0 0 0 6 13 1 0 0 0 6 14 1 6 0 0 7 15 1 0 0 0 11 16 1 0 0 0 11 17 1 0 0 0 11 18 1 1 0 0 15 19 1 0 0 0 15 20 1 0 0 0 16 21 1 0 0 0 17 22 1 0 0 0 19 23 1 0 0 0 21 24 1 0 0 0 23 25 1 0 0 0 24 26 1 6 0 0 25 27 1 0 0 0 25 28 2 0 0 0 27 29 1 0 0 0 29 30 1 0 0 0 30 31 1 0 0 0 30 32 2 0 0 0 7 10 1 0 0 0 8 12 1 0 0 0 13 16 1 0 0 0 22 24 1 0 0 0 16 33 1 1 0 0 M END