RDKit 3D 44 47 0 0 0 0 0 0 0 0999 V2000 -0.0697 1.9612 3.4738 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1290 2.1781 2.8008 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2617 1.7614 1.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1706 1.1766 0.8124 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0423 0.9403 1.4778 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1377 1.3330 2.8222 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1140 0.2806 0.8123 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2568 0.2147 -0.5593 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6897 0.7976 -1.4654 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4072 -0.6413 -0.8267 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9393 -1.0724 -2.0288 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0822 -1.8792 -1.9765 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6571 -2.2225 -0.7275 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1005 -1.7699 0.4793 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9696 -0.9778 0.3859 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1637 -0.3593 1.4357 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4775 -0.4718 2.6074 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8635 -3.0612 -0.6955 N 0 0 0 0 0 4 0 0 0 0 0 0 -7.3443 -3.4214 -1.7789 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3345 -3.3491 0.4134 O 0 0 0 0 0 1 0 0 0 0 0 0 2.5817 1.9298 0.8005 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2536 2.9187 1.0754 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9152 0.8998 -0.0458 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0519 0.7219 -0.8593 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0663 1.6830 -0.9431 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1785 1.4751 -1.7624 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2804 0.3037 -2.5045 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2796 -0.6618 -2.4361 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1478 -0.4731 -1.6156 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0777 -1.5554 -1.5783 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2551 -2.5841 -2.3018 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0703 -1.3538 -0.8181 O 0 0 0 0 0 1 0 0 0 0 0 0 7.7872 0.0256 -3.6131 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.1720 2.2666 4.5118 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9678 2.6451 3.3116 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3018 0.8640 -0.2221 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0498 1.1812 3.3928 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4768 -0.7962 -2.9729 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5149 -2.2359 -2.9106 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5174 -2.0187 1.4512 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2834 0.0834 -0.0935 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0107 2.6071 -0.3776 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9525 2.2346 -1.8103 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3581 -1.5785 -3.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 5 7 1 0 7 8 1 0 8 9 2 0 8 10 1 0 10 11 2 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 13 18 1 0 18 19 2 0 18 20 1 0 3 21 1 0 21 22 2 0 21 23 1 0 23 24 1 0 24 25 2 0 25 26 1 0 26 27 2 0 27 28 1 0 28 29 2 0 29 30 1 0 30 31 2 0 30 32 1 0 27 33 1 0 6 1 1 0 16 7 1 0 15 10 1 0 29 24 1 0 1 34 1 0 2 35 1 0 4 36 1 0 6 37 1 0 11 38 1 0 12 39 1 0 14 40 1 0 23 41 1 0 25 42 1 0 26 43 1 0 28 44 1 0 M CHG 3 18 1 20 -1 32 -1 M END