RDKit 3D 58 61 0 0 0 0 0 0 0 0999 V2000 7.9920 -0.1534 -1.3921 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1569 -0.3364 -0.0876 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7684 -0.0535 -0.5478 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7871 0.5236 -1.7833 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2823 0.8004 -2.4267 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5034 0.1962 -0.9825 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4436 -0.2895 -0.0571 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1183 -0.9916 1.1833 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0677 -1.5887 1.3868 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0524 -0.9085 2.1781 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1423 0.2416 -0.9959 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2104 0.2644 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3206 0.9451 1.2381 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2940 0.8397 2.1589 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7972 0.1090 1.8875 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8643 -0.5086 0.7045 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0865 -0.4280 -0.2343 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0180 -1.2322 0.4790 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5191 -1.3178 -0.8821 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0760 0.0076 -1.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3142 0.5579 -0.6789 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5195 -0.2456 -0.9243 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7794 -1.2634 0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9293 -0.9005 1.0742 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1759 -0.6846 0.4012 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0134 -0.1711 -0.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7083 0.6182 -1.1035 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2708 1.5039 3.3955 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3867 1.8629 1.4839 N 0 0 0 0 0 4 0 0 0 0 0 0 2.4756 2.8519 0.7443 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1100 1.6477 2.4698 O 0 0 0 0 0 1 0 0 0 0 0 0 7.1421 0.7407 -2.3408 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9827 0.2685 -1.1971 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1381 -1.1352 -1.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2760 -1.3464 0.3137 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4663 0.3962 0.6652 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6889 -0.1239 2.1861 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7329 -1.2342 3.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7036 -0.2115 -1.7963 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6827 -0.9782 1.1991 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7287 -1.6702 -1.5569 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2924 -2.0918 -0.9205 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3172 -0.1146 -2.4653 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2926 0.7747 -1.3613 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1289 0.7010 0.3926 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4616 1.5676 -1.0871 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0505 -2.1881 -0.4056 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8853 -1.4914 0.7065 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0846 -1.7077 1.7972 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6868 0.0033 1.6455 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0589 -1.0132 -1.6288 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8740 0.4726 -1.1371 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6805 1.0599 -2.1058 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6988 1.4363 -0.3708 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2626 2.5141 3.2792 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0972 1.2618 3.9425 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2420 0.4217 -3.3816 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4369 1.7909 -2.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 8 10 1 0 6 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 16 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 14 28 1 0 13 29 1 0 29 30 2 0 29 31 1 0 4 32 1 0 32 1 1 0 7 3 1 0 17 12 1 0 27 22 1 0 1 33 1 0 1 34 1 0 2 35 1 0 2 36 1 0 10 37 1 0 10 38 1 0 11 39 1 0 18 40 1 0 19 41 1 0 19 42 1 0 20 43 1 0 20 44 1 0 21 45 1 0 21 46 1 0 23 47 1 0 23 48 1 0 24 49 1 0 24 50 1 0 26 51 1 0 26 52 1 0 27 53 1 0 27 54 1 0 28 55 1 0 28 56 1 0 32 57 1 0 32 58 1 0 M CHG 2 29 1 31 -1 M END