IBS-ZINC05451279 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 -2.2900 -1.6190 -1.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9520 -1.3750 -0.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6280 -1.5770 0.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3450 -2.0670 2.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7100 -2.1210 3.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 -1.6970 3.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 -1.2030 2.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 -1.1580 1.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 -0.7140 -0.1360 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0550 -0.3100 -0.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1940 -0.8960 -1.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 -0.5150 -2.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9520 0.5790 -2.7520 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 -1.4330 -3.5170 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1000 -2.8550 -3.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1370 -0.9340 -4.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9910 -1.5180 -5.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 -0.9270 -7.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5130 -0.5670 -6.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4990 -1.1480 -5.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4290 -0.7060 -9.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6630 -2.7810 4.7500 Br 0 0 0 0 0 0 0 0 0 0 0 0 -3.0840 -1.2340 -0.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3910 -1.1210 -2.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4530 -2.6920 -1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3730 -2.3970 1.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0870 -1.7420 4.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3560 -0.8650 2.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1650 -3.0600 -3.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4750 -3.4440 -3.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 -3.1640 -2.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 0.1500 -4.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9000 -2.6090 -5.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9610 -1.3130 -5.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7120 -1.4130 -7.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1400 0.1550 -7.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3740 0.5200 -6.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4520 -0.8130 -7.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2920 -0.6780 -4.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7370 -2.2190 -5.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2720 0.3760 -9.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3610 -1.2280 -9.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4050 -0.9700 -9.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3890 -1.1700 -7.7910 N 0 3 0 0 0 0 0 0 0 0 0 0 0.5400 -2.1890 -7.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 11 2 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 26 1 0 0 0 0 5 6 1 0 0 0 0 5 22 1 0 0 0 0 6 7 2 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 19 44 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 44 1 M END