BY29BS -OEChem-04022116053D 51 54 0 1 0 0 0 0 0999 V2000 7.3923 -5.2249 -0.6922 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.4581 2.2212 0.8555 S 0 0 0 0 0 0 0 0 0 0 0 0 1.8922 4.0189 -0.7788 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0009 -0.6963 0.1008 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4764 -0.0209 0.2571 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0088 -0.6973 0.1243 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2246 1.4186 0.6186 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.5575 -3.0265 -0.4162 O 0 5 0 0 0 0 0 0 0 0 0 0 -8.6127 -0.8895 0.1013 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8973 1.4578 0.6079 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7204 -0.1916 0.2927 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.9585 -1.9415 -0.1591 N 0 3 0 0 0 0 0 0 0 0 0 0 0.5628 3.6743 -0.3538 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1767 4.9884 -0.1705 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4451 5.8363 -1.2515 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6271 2.8352 0.9076 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8908 5.3889 -1.2073 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2736 1.0177 0.5498 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1401 0.5019 0.3643 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5595 1.0245 0.5019 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1008 -0.1765 0.3385 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6810 1.0405 0.6287 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8733 -1.3608 0.0963 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1120 -1.5244 0.7163 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3854 -2.3490 -0.7587 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8136 0.2959 0.3443 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8630 -2.6761 0.4812 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1363 -3.5007 -0.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6613 -0.8657 0.0718 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3751 -3.6642 -0.3741 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3490 -2.1674 -0.2447 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5839 -2.8420 -0.3963 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5628 -1.9046 -0.1618 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1033 3.1152 -1.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2608 4.8840 -0.2688 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 5.4272 0.8111 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3258 6.9110 -1.0919 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0043 5.5825 -2.2229 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3446 2.9042 1.4039 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3049 3.2511 1.6598 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3860 5.4715 -2.1788 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4621 5.9668 -0.4733 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7230 1.8300 -0.2204 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7103 1.3745 1.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7240 1.3141 0.7089 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5177 -0.7857 1.4027 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4248 -2.2422 -1.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8245 -2.7904 0.9752 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7424 -4.2607 -1.6638 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3588 -2.5864 -0.3545 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7343 -3.8829 -0.6459 H 0 0 0 0 0 0 0 0 0 0 0 0 1 30 1 0 0 0 0 2 18 1 0 0 0 0 2 22 1 0 0 0 0 3 13 1 0 0 0 0 3 17 1 0 0 0 0 4 19 2 0 0 0 0 5 20 1 0 0 0 0 5 26 1 0 0 0 0 6 29 1 0 0 0 0 6 33 1 0 0 0 0 7 26 2 0 0 0 0 8 12 1 0 0 0 0 9 12 2 0 0 0 0 10 16 1 0 0 0 0 10 18 1 0 0 0 0 10 19 1 0 0 0 0 11 18 2 0 0 0 0 11 21 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 17 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 19 20 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 24 27 1 0 0 0 0 24 46 1 0 0 0 0 25 28 2 0 0 0 0 25 47 1 0 0 0 0 26 29 1 0 0 0 0 27 30 2 0 0 0 0 27 48 1 0 0 0 0 28 30 1 0 0 0 0 28 49 1 0 0 0 0 29 31 2 0 0 0 0 31 32 1 0 0 0 0 31 50 1 0 0 0 0 32 33 2 0 0 0 0 32 51 1 0 0 0 0 M CHG 2 8 -1 12 1 M END $$$$