BS97QD -OEChem-04022101562D 40 43 0 1 0 0 0 0 0999 V2000 2.9501 0.0000 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 5.8557 6.5696 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8557 8.1791 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4282 6.8957 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 2.2675 6.3675 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1775 6.8743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2594 5.3259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1775 7.8743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0435 6.3743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4538 7.8871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3192 8.3713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1615 4.8051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0596 5.3328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9095 6.8743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0435 8.3743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9095 7.8743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5466 6.4237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1532 3.7201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0115 4.8122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4393 7.3743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0928 3.1776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0282 3.7274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5218 5.9595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6494 5.4367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0459 4.7438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2520 8.4734 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8410 7.7927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7203 8.8441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9252 8.8500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0435 8.9943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2539 6.9702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 6.1310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8392 5.8771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6150 3.4122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5423 5.1325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9002 6.9596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9002 7.7891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0952 2.5576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5687 3.4236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9501 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 40 1 0 0 0 0 2 14 1 0 0 0 0 2 20 1 0 0 0 0 3 16 1 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 4 17 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 23 1 6 0 0 0 6 8 1 0 0 0 0 6 9 2 0 0 0 0 7 12 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 11 1 0 0 0 0 8 15 2 0 0 0 0 9 13 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 18 2 0 0 0 0 13 19 2 0 0 0 0 14 16 2 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 21 1 0 0 0 0 18 34 1 0 0 0 0 19 22 1 0 0 0 0 19 35 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 M END $$$$