RDKit 3D 36 38 0 0 0 0 0 0 0 0999 V2000 4.5169 0.0828 -2.2023 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9481 1.3673 -1.8919 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6270 1.9259 -0.6555 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8645 1.2051 0.2759 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4044 -0.0873 -0.0299 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7561 -0.6373 -1.2785 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5942 -0.9092 0.8582 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5782 -2.2184 1.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5709 -2.4921 1.9168 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0237 -1.3364 2.2306 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6205 -0.2880 1.5890 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3061 -1.1657 3.3354 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.7573 0.5703 3.0611 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2579 0.8209 1.6462 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7832 1.7300 0.9698 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2891 -0.0153 1.2714 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9907 -0.0478 0.0504 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7797 0.8364 -1.0059 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5301 0.7162 -2.1806 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4933 -0.2859 -2.3053 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7140 -1.1761 -1.2556 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9633 -1.0504 -0.0885 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1582 -1.9133 0.9619 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5740 2.0557 1.9550 Br 0 0 0 0 0 0 0 0 0 0 0 0 4.7694 -0.3614 -3.1623 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5402 1.9324 -2.6076 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9840 2.9265 -0.4212 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4256 -1.6420 -1.5433 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5525 0.8473 3.7608 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1043 1.2148 3.2637 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5660 -0.7544 1.9144 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0408 1.6291 -0.9477 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3585 1.4104 -3.0001 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0705 -0.3703 -3.2228 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4663 -1.9504 -1.3648 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8246 -2.5695 0.6960 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 2 0 8 9 1 0 9 10 2 0 10 11 1 0 10 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 14 16 1 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 22 23 1 0 4 24 1 0 6 1 1 0 11 7 1 0 22 17 1 0 1 25 1 0 2 26 1 0 3 27 1 0 6 28 1 0 13 29 1 0 13 30 1 0 16 31 1 0 18 32 1 0 19 33 1 0 20 34 1 0 21 35 1 0 23 36 1 0 M END