IBS-ZINC05451650 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 -1.9230 -0.7120 1.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1510 -1.9150 0.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7010 -2.6210 -0.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5180 -2.2150 -2.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6520 -1.9890 -3.3150 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4190 -1.0080 -3.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2640 -1.3690 -1.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -2.7330 -4.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6020 -3.7180 -4.4810 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -2.3150 -5.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5490 -3.0940 -6.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0320 -2.2580 -7.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8350 -2.4760 -8.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1170 -1.3960 -9.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6150 -0.1220 -9.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8150 0.1120 -8.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 -0.9760 -7.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2080 -1.0440 -6.2120 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 -0.2650 -5.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1980 -1.6730 -11.1170 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.2660 0.1530 1.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7300 -0.4270 0.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3800 -0.9460 2.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4210 -2.2230 1.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8090 -2.7600 0.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1850 -3.5750 -1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3410 -2.6780 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0500 -1.2760 -1.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2740 -2.9790 -2.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -0.0290 -2.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0870 -0.9430 -3.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9660 -0.5610 -1.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8100 -2.3060 -2.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7270 -4.1560 -6.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2240 -3.4680 -8.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8400 0.7060 -9.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4190 1.1020 -7.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3740 -1.5680 -0.6470 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1160 -0.6810 -0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 38 39 1 0 0 0 0 M CHG 1 38 1 M END