KEGG:C11778 3-Acetylmorphine ISISHOST03240423292D 1 1.00000 0.00000 12969 25 29 0 1 0 999 V2000 -2.9858 -2.0220 0.0000 C 0 0 0 0 0 0 0 0 0 -2.3110 -1.6391 0.0000 O 0 0 0 0 0 0 0 0 0 -3.6553 -1.6327 0.0000 O 0 0 0 0 0 0 0 0 0 -2.9898 -2.7970 0.0000 C 0 0 0 0 0 0 0 0 0 -0.9677 -3.9689 0.0000 C 0 0 2 0 0 0 0 0 0 -0.9677 -3.1964 0.0000 C 0 0 0 0 0 0 0 0 0 -0.2980 -4.3626 0.0000 C 0 0 2 0 0 0 0 0 0 -1.6374 -4.3523 0.0000 C 0 0 1 0 0 0 0 0 0 -0.2980 -3.5309 0.0000 C 0 0 0 0 0 0 0 0 0 -1.6408 -2.8095 0.0000 C 0 0 0 0 0 0 0 0 0 -0.2911 -2.8095 0.0000 C 0 0 0 0 0 0 0 0 0 0.3751 -3.9758 0.0000 C 0 0 1 0 0 0 0 0 0 -0.3049 -5.1323 0.0000 C 0 0 0 0 0 0 0 0 0 -2.4243 -3.6033 0.0000 O 0 0 0 0 0 0 0 0 0 -1.6443 -5.1289 0.0000 C 0 0 2 0 0 0 0 0 0 1.0759 -3.5275 0.0000 C 0 0 0 0 0 0 0 0 0 -1.6408 -2.0294 0.0000 C 0 0 0 0 0 0 0 0 0 0.3786 -3.2033 0.0000 C 0 0 0 0 0 0 0 0 0 -0.2911 -2.0294 0.0000 C 0 0 0 0 0 0 0 0 0 1.0517 -4.3661 0.0000 N 0 0 3 0 0 0 0 0 0 -0.9746 -5.5151 0.0000 C 0 0 0 0 0 0 0 0 0 -2.3167 -5.5082 0.0000 O 0 0 0 0 0 0 0 0 0 -0.9677 -1.6432 0.0000 C 0 0 0 0 0 0 0 0 0 1.7828 -3.9964 0.0000 C 0 0 0 0 0 0 0 0 0 0.4889 -4.8247 0.0000 H 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 1 4 1 0 0 0 1 2 1 0 0 0 5 6 1 0 0 0 5 7 1 0 0 0 5 8 1 0 0 0 5 9 1 1 0 0 6 10 1 0 0 0 6 11 2 0 0 0 7 12 1 0 0 0 7 13 1 0 0 0 8 14 1 6 0 0 8 15 1 0 0 0 9 16 1 0 0 0 10 17 2 0 0 0 11 18 1 0 0 0 11 19 1 0 0 0 12 20 1 1 0 0 13 21 2 0 0 0 15 22 1 6 0 0 17 23 1 0 0 0 17 2 1 0 0 0 20 24 1 0 0 0 10 14 1 0 0 0 12 18 1 0 0 0 15 21 1 0 0 0 16 20 1 0 0 0 19 23 2 0 0 0 7 25 1 1 0 0 M END