BR9Y1K -OEChem-04012115253D 55 58 0 0 0 0 0 0 0999 V2000 2.0366 0.7346 -1.3863 S 0 0 0 0 0 0 0 0 0 0 0 0 10.1037 -0.0770 1.2030 O 0 5 0 0 0 0 0 0 0 0 0 0 9.7863 1.4803 -0.3114 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6666 -1.3442 -0.5453 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6877 1.1047 -1.1265 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8927 -0.5053 0.1833 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3528 0.5693 0.4339 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.5457 -0.9952 -0.1166 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6670 0.0996 -0.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9115 -2.3679 -0.3646 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2185 -0.0148 -0.2517 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4550 -2.4006 0.1031 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9649 -0.9375 -0.6749 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2667 -1.4207 -0.1279 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4263 -0.3984 -0.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7732 0.1520 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0412 -0.4851 -0.4813 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5063 -0.1298 1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7755 1.4257 -0.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2558 0.8804 1.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5250 2.4359 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2651 2.1631 1.1755 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6293 0.3891 -0.7053 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7714 0.6262 -0.4358 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2492 -0.3777 0.3749 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1224 0.9747 -0.4503 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1115 -1.0866 1.2282 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9663 0.2590 0.4054 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4719 -0.7538 1.2305 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5733 -0.8419 0.9718 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6938 0.0367 -1.8269 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0357 1.0934 -0.4569 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4776 -3.1439 0.1645 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9569 -2.6137 -1.4338 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6888 0.7794 -0.7833 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1634 0.2080 0.8219 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4168 -2.3027 1.1961 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0392 -3.3833 -0.1503 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9590 -0.8072 -1.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4771 -1.8939 -0.5032 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8741 -2.4224 -0.3442 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1658 -1.2584 0.9532 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7459 0.6265 -0.6836 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5278 -0.5694 -1.9735 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1377 -0.2986 0.5941 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4276 -1.4883 -0.6918 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5042 -1.1247 1.5564 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2113 1.6492 -1.4789 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8317 0.6683 2.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5339 3.4343 -0.4023 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8489 2.9497 1.6448 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6920 1.8476 -1.8132 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4722 1.7665 -1.1039 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7365 -1.8752 1.8729 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1212 -1.3155 1.8987 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 1 23 1 0 0 0 0 2 7 1 0 0 0 0 3 7 2 0 0 0 0 4 11 1 0 0 0 0 4 12 1 0 0 0 0 4 14 1 0 0 0 0 5 23 1 0 0 0 0 5 24 1 0 0 0 0 5 52 1 0 0 0 0 6 23 2 0 0 0 0 6 25 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 13 1 0 0 0 0 8 30 1 0 0 0 0 9 11 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 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 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 16 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 17 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 20 1 0 0 0 0 18 47 1 0 0 0 0 19 21 2 0 0 0 0 19 48 1 0 0 0 0 20 22 2 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 22 51 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 25 27 1 0 0 0 0 26 28 2 0 0 0 0 26 53 1 0 0 0 0 27 29 2 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 29 55 1 0 0 0 0 M CHG 2 2 -1 7 1 M END $$$$