BGTH52 -OEChem-04022108213D 33 34 0 0 0 0 0 0 0999 V2000 -4.0752 3.2185 0.7961 Br 0 0 0 0 0 0 0 0 0 0 0 0 4.0738 -3.2183 0.7955 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.9729 -1.9341 0.1983 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9714 1.9343 0.1984 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6603 -1.5467 -1.4992 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6586 1.5471 -1.4996 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5945 -2.3698 -1.9698 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5927 2.3702 -1.9699 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0007 0.0000 2.0372 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2349 0.2070 1.2226 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2513 -0.2098 1.2108 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6747 -0.7719 0.3313 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6732 0.7721 0.3313 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9509 1.3961 1.3614 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9494 -1.3959 1.3612 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8302 -0.5616 -0.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8286 0.5619 -0.4213 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1063 1.6064 0.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1049 -1.6062 0.6086 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5460 0.6276 -0.2822 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5444 -0.6273 -0.2826 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3074 -1.5698 -1.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3057 1.5701 -1.3582 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1833 0.8595 2.6966 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1691 -0.8407 2.7235 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6089 2.1600 2.0561 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6074 -2.1560 2.0588 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4412 0.8115 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4395 -0.8112 -0.8725 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5844 -2.1748 1.0546 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4203 2.5432 -0.4087 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9731 -2.2285 -2.1314 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9713 2.2290 -2.1317 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 2 19 1 0 0 0 0 3 12 1 0 0 0 0 3 30 1 0 0 0 0 4 13 1 0 0 0 0 4 31 1 0 0 0 0 5 22 1 0 0 0 0 5 32 1 0 0 0 0 6 23 1 0 0 0 0 6 33 1 0 0 0 0 7 22 2 0 0 0 0 8 23 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 24 1 0 0 0 0 9 25 1 0 0 0 0 10 12 2 0 0 0 0 10 14 1 0 0 0 0 11 13 2 0 0 0 0 11 15 1 0 0 0 0 12 16 1 0 0 0 0 13 17 1 0 0 0 0 14 18 2 0 0 0 0 14 26 1 0 0 0 0 15 19 2 0 0 0 0 15 27 1 0 0 0 0 16 20 2 0 0 0 0 16 22 1 0 0 0 0 17 21 2 0 0 0 0 17 23 1 0 0 0 0 18 20 1 0 0 0 0 19 21 1 0 0 0 0 20 28 1 0 0 0 0 21 29 1 0 0 0 0 M END $$$$