RDKit 3D 52 56 0 0 0 0 0 0 0 0999 V2000 -6.1475 -1.5729 1.6657 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7152 -0.1914 1.1777 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5639 0.7978 2.3319 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4457 -0.3108 0.3498 N 0 0 0 0 0 4 0 0 0 0 0 0 -4.1541 0.9321 -0.5002 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1256 0.6048 -1.6013 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9620 -0.1727 -1.0597 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0232 -0.7953 0.1768 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5843 -1.6135 0.5765 S 0 0 0 0 0 0 0 0 0 0 0 0 0.1225 -1.1811 -0.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6972 -0.4075 -1.6886 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1709 0.0083 -2.9622 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0363 -0.1525 -3.3539 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9595 -0.7893 -2.3893 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3522 -1.5541 -1.3000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9449 0.2397 -1.8993 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2535 1.5307 -2.2725 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2956 1.9607 -1.4146 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5711 0.9108 -0.5582 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7474 -0.1387 -0.8571 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5077 0.7058 0.5474 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3877 1.7291 0.9344 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2784 1.5465 1.9986 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3015 0.3373 2.6929 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4362 -0.6858 2.3162 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5483 -0.5101 1.2542 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4567 -2.3262 3.2550 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.0338 0.6126 -3.7976 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1914 -0.7620 1.1033 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4540 -1.9845 2.4084 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2198 -2.2819 0.8323 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1345 -1.5145 2.1391 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4854 0.1767 0.4858 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8598 0.4416 3.0926 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2298 1.7803 1.9845 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5301 0.9430 2.8307 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6207 -1.0663 -0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7800 1.7076 0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0982 1.2620 -0.9501 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7869 1.5414 -2.0541 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6108 0.0093 -2.3861 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5441 -1.5141 -2.9699 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0327 -1.8352 -0.5972 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7837 2.0905 -3.0708 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7865 2.9242 -1.4244 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3942 2.6859 0.4121 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9533 2.3498 2.2838 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9933 0.2037 3.5184 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8844 -1.3251 0.9769 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5365 0.8106 -4.6105 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3981 -1.7568 1.5111 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0121 -0.0460 1.9145 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 1 0 14 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 19 20 1 0 19 21 1 0 21 22 2 0 22 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 25 27 1 0 12 28 1 0 8 29 1 0 29 4 1 0 11 7 1 0 15 10 1 0 20 16 1 0 26 21 1 0 1 30 1 0 1 31 1 0 1 32 1 0 2 33 1 0 3 34 1 0 3 35 1 0 3 36 1 0 4 37 1 0 5 38 1 0 5 39 1 0 6 40 1 0 6 41 1 0 14 42 1 6 15 43 1 0 17 44 1 0 18 45 1 0 22 46 1 0 23 47 1 0 24 48 1 0 26 49 1 0 28 50 1 0 29 51 1 0 29 52 1 0 M CHG 1 4 1 M END