BP0GC3 -OEChem-04022114473D 46 49 0 0 0 0 0 0 0999 V2000 -8.5037 0.2953 0.0304 F 0 0 0 0 0 0 0 0 0 0 0 0 3.1086 -1.8953 -0.2218 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9659 -2.6384 -0.3091 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2663 2.7995 0.3327 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6507 -0.4671 -0.0534 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1140 -0.2084 -0.0237 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9924 -0.0355 -0.0054 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8741 -0.0161 -1.2587 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8759 -0.3086 1.2208 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1976 0.7012 -0.9902 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2788 -0.8626 0.9698 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2493 -0.2919 -0.0328 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3820 0.0479 0.0035 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1195 0.7339 0.0881 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5728 0.4748 0.0576 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7396 -1.6911 -0.1977 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0176 -0.8342 -0.0968 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6269 2.1529 0.2548 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0136 1.2128 -0.4322 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1427 -1.0333 0.4482 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5510 1.4743 0.1756 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3737 -1.1679 -0.1363 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4059 1.2964 -0.4231 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5349 -0.9498 0.4573 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9146 1.1587 0.1382 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3257 -0.1623 -0.0177 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1666 0.2150 0.0216 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0658 -0.9954 -1.7148 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2925 0.5709 -1.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3595 -0.9611 1.9357 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9437 0.6860 1.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7329 0.7843 -1.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0065 1.7154 -0.6183 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8081 -0.8822 1.9304 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2142 -1.8919 0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5349 2.2272 0.2573 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9592 2.5723 1.2101 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9670 2.7842 -0.5728 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4503 2.0782 -0.7702 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6825 -1.9602 0.7796 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6812 -2.2029 -0.2583 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8984 2.2042 -0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1279 -1.7926 0.8003 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6625 1.9433 0.2309 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0882 3.3151 0.3935 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1662 0.3520 0.0433 H 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 2 16 1 0 0 0 0 2 17 1 0 0 0 0 3 16 2 0 0 0 0 4 21 1 0 0 0 0 4 45 1 0 0 0 0 5 26 1 0 0 0 0 5 46 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 6 12 1 0 0 0 0 7 10 1 0 0 0 0 7 11 1 0 0 0 0 7 13 1 0 0 0 0 8 10 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 11 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 14 2 0 0 0 0 12 16 1 0 0 0 0 13 19 2 0 0 0 0 13 20 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 17 1 0 0 0 0 15 21 2 0 0 0 0 17 22 2 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 23 1 0 0 0 0 19 39 1 0 0 0 0 20 24 2 0 0 0 0 20 40 1 0 0 0 0 21 25 1 0 0 0 0 22 26 1 0 0 0 0 22 41 1 0 0 0 0 23 27 2 0 0 0 0 23 42 1 0 0 0 0 24 27 1 0 0 0 0 24 43 1 0 0 0 0 25 26 2 0 0 0 0 25 44 1 0 0 0 0 M END $$$$