D06UJA -OEChem-10191522252D 42 45 0 0 0 0 0 0 0999 V2000 2.8764 -4.6932 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 7.6106 -1.5086 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9975 -1.5086 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2279 -2.4325 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0012 4.6932 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3040 -0.2020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3801 -0.5847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2279 -0.5847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6730 0.1224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3801 -2.4325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3040 -2.8152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6106 -1.5086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9318 1.0883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2247 1.7954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7071 -0.1364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2588 1.5366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.5707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4836 2.7614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5441 -3.0538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4559 -3.8457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6721 -4.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6344 -4.4861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7765 3.4685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4495 3.0202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0353 4.4344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7083 3.9861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6814 0.2898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9266 0.2898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8426 -0.5038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3088 0.0300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5307 1.2488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6663 -2.8709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5466 -0.7353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8204 1.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4011 0.4102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9741 -2.8099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0314 -4.0763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7177 -5.1005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1776 3.3080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8879 2.5818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5969 4.8728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3072 4.1466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 2 12 2 0 0 0 0 3 7 2 0 0 0 0 3 10 1 0 0 0 0 4 11 1 0 0 0 0 4 12 1 0 0 0 0 4 32 1 0 0 0 0 5 25 2 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 27 1 0 0 0 0 6 28 1 0 0 0 0 7 9 1 0 0 0 0 8 12 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 9 13 1 0 0 0 0 9 15 2 0 0 0 0 10 11 2 0 0 0 0 10 19 1 0 0 0 0 11 20 1 0 0 0 0 13 14 2 0 0 0 0 13 31 1 0 0 0 0 14 16 1 0 0 0 0 14 18 1 0 0 0 0 15 17 1 0 0 0 0 15 33 1 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 35 1 0 0 0 0 18 23 2 0 0 0 0 18 24 1 0 0 0 0 19 21 2 0 0 0 0 19 36 1 0 0 0 0 20 22 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 22 38 1 0 0 0 0 23 25 1 0 0 0 0 23 39 1 0 0 0 0 24 26 2 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 26 42 1 0 0 0 0 M END $$$$