IBS-ZINC02291772 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 0 0 1 0 0 0 0 0999 V2000 0.7650 2.1150 -0.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8360 0.7060 -0.0490 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2380 -0.0680 -1.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5580 0.5170 -2.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9670 -0.2700 -3.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0580 -1.6420 -3.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7400 -2.2320 -2.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3350 -1.4480 -0.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0280 -2.0260 0.2500 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1510 -3.4470 0.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5040 -2.4960 -4.3780 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7340 -3.5000 -4.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4010 -2.5670 -5.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3950 -1.6900 -6.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3830 -1.7550 -7.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6280 -2.7030 -7.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6160 -3.5790 -6.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4000 -3.5130 -5.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4180 -4.7140 -3.8150 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.6240 -2.7700 -8.2080 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6270 -3.7680 -8.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3760 -0.8930 -8.4670 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4440 0.0540 -8.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6990 -1.9070 -4.9870 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5440 -2.6800 -5.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3630 -3.8780 -5.7590 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7510 2.4880 -0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 2.3190 -1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 2.6130 0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4880 1.5880 -2.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2160 0.1870 -4.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8120 -3.3030 -1.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1810 -3.7360 0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8760 -3.7780 1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4880 -3.9120 -0.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1800 -0.9550 -6.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3990 -4.3150 -6.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1630 -4.7540 -8.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1240 -3.5980 -7.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3590 -3.7120 -8.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4330 0.6800 -7.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 -0.4750 -8.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3180 0.6790 -9.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8820 -0.9600 -4.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3830 -2.2330 -6.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 24 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 22 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 M END