KEGG:C07712 Secalciferol ISISHOST03240423182D 1 1.00000 0.00000 6757 30 32 0 0 0 999 V2000 0.0207 0.1862 0.0000 C 0 0 1 0 0 0 0 0 0 0.0172 -0.6207 0.0000 C 0 0 3 0 0 0 0 0 0 0.7207 0.5862 0.0000 C 0 0 3 0 0 0 0 0 0 -0.6793 0.5897 0.0000 C 0 0 0 0 0 0 0 0 0 0.0138 0.9241 0.0000 C 0 0 0 0 0 0 0 0 0 -0.6793 -1.0276 0.0000 C 0 0 0 0 0 0 0 0 0 1.4172 -0.6276 0.0000 C 0 0 0 0 0 0 0 0 0 1.4207 0.1793 0.0000 C 0 0 0 0 0 0 0 0 0 0.7241 1.3966 0.0000 C 0 0 3 0 0 0 0 0 0 -1.3759 0.1862 0.0000 C 0 0 0 0 0 0 0 0 0 -0.6759 -1.8345 0.0000 C 0 0 0 0 0 0 0 0 0 -1.3759 -0.6207 0.0000 C 0 0 0 0 0 0 0 0 0 1.4276 1.7966 0.0000 C 0 0 0 0 0 0 0 0 0 0.0276 1.8035 0.0000 C 0 0 0 0 0 0 0 0 0 -1.3724 -2.2414 0.0000 C 0 0 0 0 0 0 0 0 0 2.1276 1.3897 0.0000 C 0 0 0 0 0 0 0 0 0 -2.0759 -1.8379 0.0000 C 0 0 0 0 0 0 0 0 0 2.8276 1.7897 0.0000 C 0 0 2 0 0 0 0 0 0 -2.0759 -1.0345 0.0000 C 0 0 0 0 0 0 0 0 0 -2.7759 -2.2483 0.0000 C 0 0 0 0 0 0 0 0 0 3.5276 1.3828 0.0000 C 0 0 3 0 0 0 0 0 0 2.8310 2.6000 0.0000 O 0 0 0 0 0 0 0 0 0 -2.7793 -0.6310 0.0000 C 0 0 0 0 0 0 0 0 0 -2.1138 -0.2448 0.0000 C 0 0 0 0 0 0 0 0 0 -3.4724 -1.8448 0.0000 C 0 0 2 0 0 0 0 0 0 4.2276 1.7862 0.0000 C 0 0 0 0 0 0 0 0 0 3.5310 0.5517 0.0000 C 0 0 0 0 0 0 0 0 0 4.2241 0.9207 0.0000 O 0 0 0 0 0 0 0 0 0 -3.4759 -1.0379 0.0000 C 0 0 0 0 0 0 0 0 0 -4.1862 -2.2552 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 1 0 0 2 6 1 0 0 0 2 7 1 0 0 0 3 8 1 0 0 0 3 9 1 0 0 0 4 10 1 0 0 0 6 11 2 0 0 0 6 12 1 0 0 0 9 13 1 0 0 0 9 14 1 0 0 0 11 15 1 0 0 0 13 16 1 0 0 0 15 17 2 0 0 0 16 18 1 0 0 0 17 19 1 0 0 0 17 20 1 0 0 0 18 21 1 0 0 0 18 22 1 1 0 0 19 23 1 0 0 0 19 24 2 0 0 0 20 25 1 0 0 0 21 26 1 0 0 0 21 27 1 0 0 0 21 28 1 0 0 0 23 29 1 0 0 0 25 30 1 1 0 0 7 8 1 0 0 0 10 12 1 0 0 0 25 29 1 0 0 0 M END