RDKit 3D 51 54 0 0 0 0 0 0 0 0999 V2000 -4.0231 3.4606 -1.7197 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4585 2.1984 -1.9371 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5979 1.6418 -0.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3281 2.3679 0.1907 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8877 3.6350 0.4253 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7368 4.1619 -0.5526 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5063 5.8690 -0.2798 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.2532 1.4526 1.1752 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.2421 0.1930 0.0161 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9640 0.4160 -1.0533 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4809 -0.9508 0.2503 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3899 -1.2262 1.3849 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8658 -1.4387 1.0079 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4974 -0.4576 0.0175 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3226 0.9919 0.3945 N 0 0 0 0 0 4 0 0 0 0 0 0 2.9472 1.3635 1.7386 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2471 2.8630 1.7789 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2175 3.2540 0.8029 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1878 2.4861 -0.4073 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7990 1.9310 -0.7303 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5199 -1.8701 -0.7953 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0475 -1.6562 -1.8667 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2126 -3.1666 -0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2175 -4.1165 -1.4348 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8522 -5.3320 -1.3364 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7695 -5.3635 -0.2346 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1609 -4.7063 0.9973 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8271 -3.3298 0.7489 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6873 3.8821 -2.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6799 1.6443 -2.8458 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6706 4.1837 1.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0337 -2.1319 1.8873 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3278 -0.4330 2.1333 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9690 -2.4429 0.5742 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4580 -1.4591 1.9321 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5746 -0.6432 -0.0661 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0617 -0.5795 -0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3128 1.1711 0.4521 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2327 1.0756 2.5139 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8706 0.7820 1.8374 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6346 3.1454 2.7636 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3348 3.4452 1.6084 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9177 1.6754 -0.3145 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5279 3.1390 -1.2155 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7800 1.3826 -1.6763 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0584 2.7381 -0.7698 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7234 -4.0297 -2.3961 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6899 -4.8505 -0.5415 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0130 -6.4112 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8668 -4.7308 1.8331 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2467 -5.2242 1.3096 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 6 7 1 0 4 8 1 0 8 9 1 0 9 10 2 0 9 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 11 21 1 0 21 22 2 0 21 23 1 0 23 24 2 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 6 1 1 0 10 3 1 0 20 15 1 0 28 23 1 0 1 29 1 0 2 30 1 0 5 31 1 0 12 32 1 0 12 33 1 0 13 34 1 0 13 35 1 0 14 36 1 0 14 37 1 0 15 38 1 0 16 39 1 0 16 40 1 0 17 41 1 0 17 42 1 0 19 43 1 0 19 44 1 0 20 45 1 0 20 46 1 0 24 47 1 0 26 48 1 0 26 49 1 0 27 50 1 0 27 51 1 0 M CHG 1 15 1 M END