BPW6Z9 -OEChem-04042104143D 52 55 0 0 0 0 0 0 0999 V2000 8.1262 -2.2683 -1.9618 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 4.6784 -0.9950 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9141 -0.6426 2.6277 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2398 -4.4786 -1.9182 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7334 0.0634 -0.2787 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0199 1.1513 1.5008 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1208 2.2420 0.6948 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5131 0.0809 1.2547 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3792 0.6791 1.3481 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5271 -0.2079 1.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0335 0.3340 1.8865 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7172 -1.3437 0.7515 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5171 1.7447 0.5561 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3045 2.5311 0.2605 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3804 0.9042 1.9497 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2988 -2.6292 1.0949 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3113 -1.1117 -0.4891 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4750 3.7220 -0.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2064 0.3018 0.8277 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4747 -3.6828 0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4873 -2.1652 -1.3861 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0690 -3.4508 -1.0425 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6243 4.2068 -1.1978 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5842 -0.4647 0.5078 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3783 5.3787 -1.9699 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0506 5.7452 -1.9456 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8391 -0.6172 1.0974 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3850 -0.8503 -0.8178 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8948 -1.1549 0.3614 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4407 -1.3880 -1.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6956 -1.5403 -0.9644 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7892 -5.7672 -1.5026 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4577 0.3763 1.7527 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4154 -0.5860 2.7433 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4822 2.0170 0.1527 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8247 1.8542 2.2677 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3804 0.2145 2.8002 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8346 -2.8237 2.0581 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6487 -0.1176 -0.7693 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1268 -4.6555 0.5286 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9519 -1.9787 -2.3505 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6080 3.7686 -1.0985 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7427 0.3362 2.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1365 5.9254 -2.5154 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5897 6.5882 -2.4407 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0077 -0.3209 2.1296 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4441 -0.7635 -1.3426 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8665 -1.2669 0.8356 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2701 -1.6836 -2.5861 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7053 -5.7830 -1.3454 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3412 -6.1231 -0.6261 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0038 -6.4636 -2.3198 H 0 0 0 0 0 0 0 0 0 0 0 0 1 31 1 0 0 0 0 2 18 1 0 0 0 0 2 26 1 0 0 0 0 3 11 2 0 0 0 0 4 22 1 0 0 0 0 4 32 1 0 0 0 0 5 19 2 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 6 15 1 0 0 0 0 7 14 2 0 0 0 0 8 19 1 0 0 0 0 8 24 1 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 13 2 0 0 0 0 10 12 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 12 16 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 18 1 0 0 0 0 15 19 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 20 1 0 0 0 0 16 38 1 0 0 0 0 17 21 2 0 0 0 0 17 39 1 0 0 0 0 18 23 2 0 0 0 0 20 22 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 23 25 1 0 0 0 0 23 42 1 0 0 0 0 24 27 2 0 0 0 0 24 28 1 0 0 0 0 25 26 2 0 0 0 0 25 44 1 0 0 0 0 26 45 1 0 0 0 0 27 29 1 0 0 0 0 27 46 1 0 0 0 0 28 30 2 0 0 0 0 28 47 1 0 0 0 0 29 31 2 0 0 0 0 29 48 1 0 0 0 0 30 31 1 0 0 0 0 30 49 1 0 0 0 0 32 50 1 0 0 0 0 32 51 1 0 0 0 0 32 52 1 0 0 0 0 M END $$$$