BNJ26I -OEChem-04022119003D 31 33 0 1 0 0 0 0 0999 V2000 -5.2937 2.7123 1.3240 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.3881 -2.6060 0.6263 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.2589 -1.5549 -1.3861 S 0 0 2 0 0 0 0 0 0 0 0 0 4.0628 1.4487 0.2067 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0623 -3.7180 -0.0107 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3312 -2.4478 2.0646 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9684 0.4576 0.7700 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5015 2.2807 -0.9047 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1938 -2.4232 -0.0251 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5031 2.4620 1.4633 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0433 -1.1474 -0.0418 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2083 -0.6059 -1.0024 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2209 -0.5502 0.3659 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5832 0.6435 -0.2551 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5758 0.5762 -1.6314 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3745 -0.3750 -0.6368 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7670 1.2029 -1.2501 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2554 -0.0658 0.7182 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3641 0.2358 -1.4072 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1258 0.8541 1.3027 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2345 1.1556 -0.8226 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1154 1.4648 0.5324 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8284 -1.0007 1.1428 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0437 1.0192 -2.4051 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0410 2.1346 -1.7383 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4972 -0.4814 1.3719 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4689 0.0054 -2.4643 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0168 1.0888 2.3586 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9999 1.6228 -1.4369 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7796 2.2270 2.4244 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4601 3.4716 1.2783 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 2 5 2 0 0 0 0 2 6 2 0 0 0 0 2 9 1 0 0 0 0 2 11 1 0 0 0 0 3 9 2 0 0 0 0 3 12 1 0 0 0 0 3 16 1 0 0 0 0 4 7 2 0 0 0 0 4 8 2 0 0 0 0 4 10 1 0 0 0 0 4 14 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 2 0 0 0 0 13 23 1 0 0 0 0 14 17 1 0 0 0 0 15 17 2 0 0 0 0 15 24 1 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 17 25 1 0 0 0 0 18 20 1 0 0 0 0 18 26 1 0 0 0 0 19 21 2 0 0 0 0 19 27 1 0 0 0 0 20 22 2 0 0 0 0 20 28 1 0 0 0 0 21 22 1 0 0 0 0 21 29 1 0 0 0 0 M END $$$$