BQBE37 -OEChem-04022118553D 36 37 0 0 0 0 0 0 0999 V2000 -4.7466 2.5976 -0.0830 Br 0 0 0 0 0 0 0 0 0 0 0 0 4.1560 0.5817 0.4317 S 0 0 0 0 0 0 0 0 0 0 0 0 4.6231 0.4376 1.8070 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3864 1.8368 -0.2748 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4263 0.9065 -1.4924 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7342 -0.2745 0.4134 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7411 -0.6688 -0.4473 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9315 0.0698 -0.1638 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6228 -1.8308 -1.3883 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4282 0.3307 0.4263 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3325 -0.0708 0.4178 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6448 0.8934 -0.5813 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8313 -0.4327 1.4296 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2645 0.6928 -0.5855 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4510 -0.6335 1.4253 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0589 -0.1995 -0.2582 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6792 0.2032 -0.5031 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0792 0.7296 -0.0555 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3430 -1.5648 -0.2299 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3838 0.2934 0.1755 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6477 -2.0010 0.0013 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6681 -1.0719 0.2039 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0189 -0.8249 -0.6689 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0890 1.4844 -1.3775 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4226 -0.8864 2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2739 1.1585 -1.3986 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0014 -1.2318 2.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0829 -0.8411 1.1842 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5627 -2.3042 -0.3924 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1923 1.0022 0.3357 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8694 -3.0640 0.0218 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6839 -1.4117 0.3835 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9241 -0.0508 -0.3354 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6674 0.8751 0.3915 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6293 -1.8677 -1.5061 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 -2.5658 -1.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 2 3 2 0 0 0 0 2 4 2 0 0 0 0 2 7 1 0 0 0 0 2 10 1 0 0 0 0 5 17 2 0 0 0 0 6 11 1 0 0 0 0 6 17 1 0 0 0 0 6 28 1 0 0 0 0 7 23 2 0 0 0 0 8 23 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 23 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 11 14 2 0 0 0 0 11 15 1 0 0 0 0 12 14 1 0 0 0 0 12 24 1 0 0 0 0 13 15 2 0 0 0 0 13 25 1 0 0 0 0 14 26 1 0 0 0 0 15 27 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 2 0 0 0 0 18 20 2 0 0 0 0 19 21 1 0 0 0 0 19 29 1 0 0 0 0 20 22 1 0 0 0 0 20 30 1 0 0 0 0 21 22 2 0 0 0 0 21 31 1 0 0 0 0 22 32 1 0 0 0 0 M END $$$$