RDKit 3D 36 38 0 0 0 0 0 0 0 0999 V2000 -4.1778 -0.4555 3.0158 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7417 -1.7093 2.8175 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5163 -2.3860 1.6208 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7227 -1.8129 0.6147 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1395 -0.5455 0.7964 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3868 0.1186 2.0169 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2904 0.1008 -0.2025 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5921 -0.3925 -1.2066 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9704 0.6702 -1.8195 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3044 1.7468 -1.1374 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1494 1.4644 -0.1014 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 3.3417 -1.4767 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6791 2.9592 -2.5764 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8428 2.3751 -1.7871 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6930 3.1049 -1.2820 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8266 1.0003 -1.6985 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7334 0.1180 -1.0612 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3192 -1.2277 -1.0346 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1076 -2.2248 -0.4531 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3329 -1.8954 0.1114 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7622 -0.5711 0.0932 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9722 0.4304 -0.4839 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5361 1.6716 -0.4294 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5379 -2.8410 -0.9772 Br 0 0 0 0 0 0 0 0 0 0 0 0 -4.3489 0.0782 3.9481 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3576 -2.1607 3.5918 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9688 -3.3653 1.4774 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9535 1.0995 2.2104 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3793 2.2900 -3.3895 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0226 3.8884 -3.0436 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9855 0.5474 -2.0557 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3636 -1.5234 -1.4652 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7619 -3.2553 -0.4445 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9547 -2.6630 0.5637 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7220 -0.3079 0.5315 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8783 2.3316 -0.7302 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