B1XB3R -OEChem-04012116022D 40 43 0 1 0 0 0 0 0999 V2000 2.9383 -0.0015 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 6.6017 -2.8413 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8101 2.8591 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9325 3.4582 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3053 1.9466 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3691 -0.9513 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 8.3374 1.7349 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9950 0.5356 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4130 -2.2566 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.4169 -1.2567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3629 -2.5693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9538 -1.7626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6818 -0.0015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0155 0.7443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3101 1.3203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6191 2.2714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3101 1.3203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6345 2.5036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0010 2.2714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6251 0.5356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9856 2.5036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2827 1.7349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6046 0.7443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.8988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5076 -2.8694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2903 -0.6497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8000 -1.3191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1085 -3.1348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8986 -2.8814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4129 -2.1792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4161 -1.3495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2281 -0.2946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0654 0.4856 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6642 -3.4582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9434 1.8662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8235 -0.0518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8009 3.0954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5904 3.0882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8107 3.4892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4096 2.7095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 9 2 1 6 0 0 0 2 34 1 0 0 0 0 3 16 1 0 0 0 0 3 19 1 0 0 0 0 4 18 2 0 0 0 0 5 22 1 0 0 0 0 5 24 1 0 0 0 0 6 10 1 0 0 0 0 6 12 1 0 0 0 0 6 13 1 0 0 0 0 7 14 1 0 0 0 0 7 18 1 0 0 0 0 7 35 1 0 0 0 0 8 14 2 0 0 0 0 8 15 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 25 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 16 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 2 0 0 0 0 19 21 2 0 0 0 0 20 23 1 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 M END $$$$