IBS-ZINC02214099 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 42 0 0 0 0 0 0 0 0999 V2000 1.0420 3.2400 0.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1140 3.7080 1.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3140 3.0280 1.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4450 1.8650 0.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3590 1.3980 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 2.0870 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7280 1.1310 0.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6730 1.5410 1.3380 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8510 0.0080 -0.0440 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0950 -0.6250 -0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1600 -2.0130 -0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3790 -2.6480 -0.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5500 -1.9060 -0.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4930 -0.5070 -0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2540 0.1290 -0.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7760 -0.0610 -0.2880 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5770 -1.0900 -0.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8610 -2.2290 -0.4540 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0500 -1.0130 -0.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8080 -2.1800 -0.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1820 -2.1040 -0.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8150 -0.8690 -0.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0660 0.2950 -0.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6900 0.2280 -0.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9330 1.9730 -0.3850 Br 0 0 0 0 0 0 0 0 0 0 0 0 16.1700 -0.7990 -0.6520 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 3.7730 0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0120 4.6090 2.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1510 3.3950 2.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4540 0.4980 -0.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3240 1.7270 -0.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0780 -0.3610 -0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2500 -2.5940 -0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4220 -3.7240 -0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2020 1.2050 -0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3170 -3.1410 -0.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7680 -3.0060 -0.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1070 1.1320 -0.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5210 -0.7120 -1.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 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 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 38 1 0 0 0 0 26 39 1 0 0 0 0 M END