BG2S3U -OEChem-04022117143D 62 66 0 1 0 0 0 0 0999 V2000 -2.1323 3.6623 -0.6290 Br 0 0 0 0 0 0 0 0 0 0 0 0 -3.0176 0.9639 0.6349 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3996 -1.8133 1.3386 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0757 -0.0065 0.0421 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4444 0.9565 0.1295 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2208 -1.4730 -0.6813 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7690 -1.2969 -1.1284 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9996 -2.1549 -1.0942 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6439 -2.7813 -0.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4769 -0.3957 0.0228 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6675 1.0717 -0.8661 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4779 1.8777 -0.3300 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1223 -0.7889 0.7169 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7648 -0.2848 0.6287 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0869 1.1696 0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6830 -0.0958 -0.0407 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3825 -1.0004 0.9708 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6915 0.4960 -1.0208 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2577 -2.0419 0.2714 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5557 -0.5957 -1.6542 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8969 2.8301 0.7908 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5161 0.0215 0.7155 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5792 -0.8777 1.0138 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3352 -0.8084 -0.0097 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3101 2.2655 -0.2474 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8834 -0.0377 0.8731 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6654 1.0494 0.4696 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0753 2.1832 -0.0817 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9793 -1.7498 1.0042 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3509 -0.3448 -1.0492 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5002 -0.8693 -2.0866 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5296 -2.3145 -2.0252 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6355 -2.1175 -0.2183 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3842 -3.1784 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2613 -3.3584 -1.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0944 0.5077 -0.0311 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7148 -0.8879 0.9736 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3924 0.5914 -1.8138 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5179 1.7347 -1.0603 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0560 2.4621 -1.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9769 -0.7052 -0.6235 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6367 -1.5063 1.5949 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9802 -0.3962 1.6648 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1571 1.0440 -1.8066 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3161 1.2440 -0.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5919 -2.7021 -0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7093 -2.7199 1.0011 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2398 -0.1621 -2.3889 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8979 -1.2311 -2.2642 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6608 3.5307 0.4379 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0427 3.4170 1.1457 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3036 2.2899 1.6529 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4836 -1.8605 1.4562 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0042 0.0795 0.5432 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7773 3.1480 -0.6736 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3334 -0.9205 1.3171 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9402 -1.3451 1.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3739 -1.8713 1.9081 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1826 -2.7375 0.5746 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0146 0.5378 -1.6021 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5964 -1.1386 -1.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2885 -0.0501 -0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 28 1 0 0 0 0 2 16 1 0 0 0 0 2 27 1 0 0 0 0 3 13 2 0 0 0 0 4 10 1 0 0 0 0 4 11 1 0 0 0 0 4 13 1 0 0 0 0 5 12 1 0 0 0 0 5 14 1 0 0 0 0 5 15 1 0 0 0 0 6 19 1 0 0 0 0 6 20 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 21 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 14 23 2 0 0 0 0 15 22 1 0 0 0 0 15 25 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 41 1 0 0 0 0 17 19 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 20 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 22 23 1 0 0 0 0 22 26 2 0 0 0 0 23 53 1 0 0 0 0 24 29 1 0 0 0 0 24 30 1 0 0 0 0 24 54 1 0 0 0 0 25 28 1 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 26 56 1 0 0 0 0 27 28 2 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 30 60 1 0 0 0 0 30 61 1 0 0 0 0 30 62 1 0 0 0 0 M END $$$$