B9GIS6 -OEChem-04022107043D 51 52 0 1 0 0 0 0 0999 V2000 4.4792 3.0327 1.9346 Br 0 0 0 0 0 0 0 0 0 0 0 0 -2.8526 -1.0899 -1.8721 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9248 1.7214 -0.8661 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3343 0.5130 0.9609 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9137 1.9896 1.7186 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2174 0.8850 -0.2981 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3585 2.5851 -1.5972 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0455 -2.4550 1.2669 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7359 -2.8900 0.5952 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1711 -2.1115 0.2873 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3551 -3.3219 1.5787 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5576 0.4261 -0.0409 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.8702 -0.9465 -0.6469 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6234 -3.8271 0.8797 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5967 1.4707 -0.4646 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3133 -2.7735 0.0505 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9665 -2.6216 -1.2836 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2831 -1.9732 0.6356 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0149 1.1636 -0.0238 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4965 1.6402 0.6175 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6045 -1.6469 -2.0507 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9210 -0.9983 -0.1316 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8638 2.0581 0.1909 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5816 -0.8352 -1.4748 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8344 2.2957 1.1334 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1436 2.2063 -1.1409 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0972 2.6871 0.7025 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3061 2.8163 -0.6611 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3957 -3.2671 1.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8410 -1.6012 1.9228 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9486 -3.7175 -0.0929 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3772 -2.0514 -0.0096 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4008 -2.9879 -0.3304 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0835 -1.8687 0.8417 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0337 -4.1247 2.2168 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6018 -2.4809 2.2386 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6527 0.3140 1.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3219 -4.2055 1.6373 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3816 -4.6925 0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3409 2.4552 -0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5885 1.5593 -1.5586 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7952 0.5943 -1.1734 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2106 -3.2508 -1.7449 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5528 -2.0906 1.6813 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3410 -1.5202 -3.0967 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6829 -0.3673 0.3165 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0805 -0.0788 -2.0732 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6302 2.1778 2.1939 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4146 2.0644 -1.9303 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8457 1.5324 -0.5856 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2691 3.1172 -1.0626 H 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 2 13 2 0 0 0 0 3 19 1 0 0 0 0 3 50 1 0 0 0 0 4 19 2 0 0 0 0 5 20 2 0 0 0 0 6 12 1 0 0 0 0 6 20 1 0 0 0 0 6 42 1 0 0 0 0 7 26 2 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 9 11 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 13 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 14 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 12 37 1 0 0 0 0 14 16 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 19 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 17 21 1 0 0 0 0 17 43 1 0 0 0 0 18 22 2 0 0 0 0 18 44 1 0 0 0 0 20 23 1 0 0 0 0 21 24 2 0 0 0 0 21 45 1 0 0 0 0 22 24 1 0 0 0 0 22 46 1 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 24 47 1 0 0 0 0 25 27 1 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 27 28 2 0 0 0 0 28 51 1 0 0 0 0 M END $$$$