D02KIE -OEChem-10101305032D 55 58 0 1 0 0 0 0 0999 V2000 11.9081 4.7012 0.0000 Br 0 5 0 0 0 0 0 0 0 0 0 0 9.5165 4.3953 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3362 4.7214 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7845 3.0484 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4384 3.9449 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2618 7.3441 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 6.7840 5.3955 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5251 6.3615 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.5160 4.3955 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.0160 5.2616 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.1572 8.3386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0793 4.3509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6605 5.9138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3021 4.9802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2437 8.7453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1753 7.7508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2492 8.6408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6559 9.5544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0774 3.7555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1114 3.4966 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4043 4.2038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8526 2.5307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5597 1.8236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8867 2.2719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3009 0.8577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6279 1.3060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3350 0.5989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0040 4.5745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3051 7.1825 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2060 3.8586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3260 5.7985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3072 8.9402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7757 8.2953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4610 3.8623 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6370 3.9163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0490 6.0161 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6388 6.5334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8872 5.4410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6338 9.2272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9231 8.3172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7417 8.0030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4275 7.1844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2059 8.0223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6476 8.7908 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1419 9.9010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0866 10.0003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5126 3.3362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1423 4.7657 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9122 4.5594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1586 1.9841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4483 2.7103 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 4.3834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7393 0.4193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 1.1455 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1745 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9 2 1 1 0 0 0 10 2 1 1 0 0 0 3 14 1 0 0 0 0 3 19 1 0 0 0 0 4 19 2 0 0 0 0 5 21 1 0 0 0 0 5 52 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 11 1 0 0 0 0 6 16 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 7 28 1 1 0 0 0 8 10 1 0 0 0 0 8 13 1 0 0 0 0 8 29 1 6 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 31 1 0 0 0 0 11 15 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 14 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 38 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 15 39 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 6 0 0 0 20 22 1 0 0 0 0 20 47 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 23 25 1 0 0 0 0 23 50 1 0 0 0 0 24 26 2 0 0 0 0 24 51 1 0 0 0 0 25 27 2 0 0 0 0 25 53 1 0 0 0 0 26 27 1 0 0 0 0 26 54 1 0 0 0 0 27 55 1 0 0 0 0 M CHG 2 1 -1 6 1 M END $$$$