KEGG:C12310 Esmeraldin B ISISHOST08180423302D 1 1.00000 0.00000 14792 49 56 0 0 0 999 V2000 15.7625 -13.2708 0.0000 C 0 0 0 0 0 0 0 0 0 17.1991 -13.2708 0.0000 C 0 0 0 0 0 0 0 0 0 16.4829 -12.8541 0.0000 C 0 0 0 0 0 0 0 0 0 15.7625 -14.1000 0.0000 C 0 0 0 0 0 0 0 0 0 15.0430 -14.5140 0.0000 N 0 0 0 0 0 0 0 0 0 15.7642 -15.7613 0.0000 C 0 0 0 0 0 0 0 0 0 15.0479 -15.3442 0.0000 C 0 0 0 0 0 0 0 0 0 14.3300 -15.7586 0.0000 C 0 0 0 0 0 0 0 0 0 14.3285 -16.5860 0.0000 C 0 0 0 0 0 0 0 0 0 15.0448 -16.9990 0.0000 C 0 0 0 0 0 0 0 0 0 15.7626 -16.5887 0.0000 C 0 0 0 0 0 0 0 0 0 17.1991 -14.1000 0.0000 C 0 0 0 0 0 0 0 0 0 16.4808 -14.5090 0.0000 C 0 0 0 0 0 0 0 0 0 16.4780 -15.3360 0.0000 N 0 0 3 0 0 0 0 0 0 17.9144 -14.5139 0.0000 C 0 0 3 0 0 0 0 0 0 17.9116 -15.3409 0.0000 C 0 0 0 0 0 0 0 0 0 17.1963 -15.7502 0.0000 C 0 0 0 0 0 0 0 0 0 17.1917 -16.5728 0.0000 C 0 0 0 0 0 0 0 0 0 17.9022 -16.9861 0.0000 C 0 0 0 0 0 0 0 0 0 18.6180 -15.7583 0.0000 C 0 0 0 0 0 0 0 0 0 18.6124 -16.5790 0.0000 C 0 0 0 0 0 0 0 0 0 19.3209 -16.9921 0.0000 N 0 0 0 0 0 0 0 0 0 19.3321 -15.3507 0.0000 N 0 0 0 0 0 0 0 0 0 20.0406 -15.7680 0.0000 C 0 0 0 0 0 0 0 0 0 20.0332 -16.5874 0.0000 C 0 0 0 0 0 0 0 0 0 20.7396 -17.0014 0.0000 C 0 0 0 0 0 0 0 0 0 21.4535 -16.6002 0.0000 C 0 0 0 0 0 0 0 0 0 21.4609 -15.7808 0.0000 C 0 0 0 0 0 0 0 0 0 20.7544 -15.3626 0.0000 C 0 0 0 0 0 0 0 0 0 18.6303 -14.1039 0.0000 C 0 0 0 0 0 0 0 0 0 20.7619 -14.5336 0.0000 C 0 0 3 0 0 0 0 0 0 21.4842 -14.1275 0.0000 O 0 0 0 0 0 0 0 0 0 20.0471 -14.1146 0.0000 C 0 0 0 0 0 0 0 0 0 17.8985 -17.8152 0.0000 C 0 0 0 0 0 0 0 0 0 17.1781 -18.2287 0.0000 O 0 0 0 0 0 0 0 0 0 18.6112 -18.2351 0.0000 O 0 0 0 0 0 0 0 0 0 13.6121 -15.3406 0.0000 C 0 0 0 0 0 0 0 0 0 13.6137 -14.5115 0.0000 O 0 0 0 0 0 0 0 0 0 12.8928 -15.7559 0.0000 O 0 0 0 0 0 0 0 0 0 21.4916 -13.2983 0.0000 C 0 0 0 0 0 0 0 0 0 22.2138 -12.8881 0.0000 C 0 0 0 0 0 0 0 0 0 20.7766 -12.8753 0.0000 O 0 0 0 0 0 0 0 0 0 22.9275 -13.3120 0.0000 C 0 0 0 0 0 0 0 0 0 23.6498 -12.9018 0.0000 C 0 0 0 0 0 0 0 0 0 23.6571 -12.0726 0.0000 C 0 0 0 0 0 0 0 0 0 22.9422 -11.6538 0.0000 C 0 0 0 0 0 0 0 0 0 22.2199 -12.0599 0.0000 C 0 0 0 0 0 0 0 0 0 21.5047 -11.6416 0.0000 O 0 0 0 0 0 0 0 0 0 22.9194 -14.1412 0.0000 C 0 0 0 0 0 0 0 0 0 20 21 1 0 0 0 21 22 2 0 0 0 22 25 1 0 0 0 24 23 1 0 0 0 23 20 2 0 0 0 9 10 1 0 0 0 10 11 2 0 0 0 11 6 1 0 0 0 4 5 1 0 0 0 5 7 1 0 0 0 6 14 1 0 0 0 24 25 2 0 0 0 25 26 1 0 0 0 26 27 2 0 0 0 27 28 1 0 0 0 28 29 2 0 0 0 29 24 1 0 0 0 12 2 2 0 0 0 15 30 1 0 0 0 12 13 1 0 0 0 29 31 1 0 0 0 13 14 1 0 0 0 31 32 1 0 0 0 17 14 1 0 0 0 31 33 1 0 0 0 16 15 1 0 0 0 19 34 1 0 0 0 15 12 1 0 0 0 34 35 2 0 0 0 2 3 1 0 0 0 34 36 1 0 0 0 3 1 2 0 0 0 8 37 1 0 0 0 37 38 1 0 0 0 1 4 1 0 0 0 37 39 2 0 0 0 32 40 1 0 0 0 16 17 2 0 0 0 40 41 1 0 0 0 17 18 1 0 0 0 40 42 2 0 0 0 18 19 2 0 0 0 19 21 1 0 0 0 20 16 1 0 0 0 13 4 2 0 0 0 6 7 2 0 0 0 41 43 2 0 0 0 43 44 1 0 0 0 44 45 2 0 0 0 45 46 1 0 0 0 46 47 2 0 0 0 47 41 1 0 0 0 7 8 1 0 0 0 47 48 1 0 0 0 8 9 2 0 0 0 43 49 1 0 0 0 M END