NCID-ZINC04778096 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 1 0 0 0 0 0999 V2000 1.3210 0.5410 -0.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0730 -0.9500 -0.3860 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5920 -1.5190 -1.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5750 -1.4130 1.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4960 -2.4340 1.3880 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6280 -3.2710 0.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5740 -3.1270 2.7220 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3440 -2.6760 3.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0130 -4.5570 2.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1530 -5.4770 3.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1870 -5.4870 4.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7560 -6.6630 4.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0460 -6.6730 5.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8500 -7.5670 5.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3160 -5.4930 6.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1250 -4.2180 5.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7740 -4.1680 4.6130 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7590 -3.1730 3.4510 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8850 -3.3860 2.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7430 -4.2340 2.7140 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9910 -2.6050 1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7910 -1.7130 1.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4430 -1.2770 -0.4380 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0100 -0.3770 -0.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7050 -2.3580 -1.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7430 -3.5130 -1.0920 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9210 -2.0040 -2.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9990 -0.3910 1.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0220 -1.4430 4.3590 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 -3.5600 5.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3910 0.7410 -0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9370 0.8480 -1.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 1.1000 0.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5480 -1.9030 0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6320 -0.5920 1.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2580 -4.9610 1.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9650 -4.4900 1.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3790 -6.4920 3.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9450 -5.1350 4.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2760 -7.5820 4.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3410 -5.5400 6.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6240 -5.4990 6.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9390 -4.1280 4.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1890 -3.3640 5.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0920 -3.3310 0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9140 -2.0040 1.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8510 -0.9230 -3.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1600 -2.4900 -3.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9090 -2.3420 -3.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6250 0.4350 1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0620 -0.2470 1.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4570 -0.4240 2.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 -3.2990 5.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2760 -2.6650 6.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3550 -4.2880 6.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 23 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 22 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 18 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 18 29 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 28 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 M END