BW53EL -OEChem-04022105262D 47 51 0 0 0 0 0 0 0999 V2000 2.0000 2.4636 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 8.5147 0.5102 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2962 -0.8454 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2927 1.3875 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6499 -0.3073 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0071 -2.0022 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3807 0.0102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6069 0.1051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9390 0.8494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2467 0.5102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4116 1.4989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4398 1.7081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1128 0.0102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9605 0.6432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9788 0.5102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2467 1.5102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9788 1.5102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1128 2.0102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3177 -1.0516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8727 -0.0245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8727 2.0449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3142 1.1812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7788 0.4894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7788 1.5310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6464 1.9256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0035 0.2307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6678 1.7193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0250 0.0245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3572 0.7688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9822 -0.4647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7792 -0.4647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8731 1.9130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1896 2.2754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1128 -0.6098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7098 1.8202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1128 2.6302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4853 1.9768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8656 -0.6444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8656 2.6648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3145 0.1773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3145 1.8431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8390 2.5149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4176 -0.2307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4211 -2.4636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4004 -2.1300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8324 -0.5648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7505 0.6410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 2 7 1 0 0 0 0 2 8 1 0 0 0 0 2 11 1 0 0 0 0 3 8 2 0 0 0 0 3 19 1 0 0 0 0 4 14 1 0 0 0 0 4 22 1 0 0 0 0 4 37 1 0 0 0 0 5 14 1 0 0 0 0 5 19 2 0 0 0 0 6 19 1 0 0 0 0 6 44 1 0 0 0 0 6 45 1 0 0 0 0 7 10 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 9 12 1 0 0 0 0 9 14 2 0 0 0 0 10 13 2 0 0 0 0 10 16 1 0 0 0 0 11 12 2 0 0 0 0 11 32 1 0 0 0 0 12 33 1 0 0 0 0 13 15 1 0 0 0 0 13 34 1 0 0 0 0 15 17 1 0 0 0 0 15 20 2 0 0 0 0 16 18 2 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 21 2 0 0 0 0 18 36 1 0 0 0 0 20 23 1 0 0 0 0 20 38 1 0 0 0 0 21 24 1 0 0 0 0 21 39 1 0 0 0 0 22 25 2 0 0 0 0 22 26 1 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 25 27 1 0 0 0 0 25 42 1 0 0 0 0 26 28 2 0 0 0 0 26 43 1 0 0 0 0 27 29 2 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 29 47 1 0 0 0 0 M END $$$$