IBS-ZINC04027863 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 44 0 0 1 0 0 0 0 0999 V2000 -0.3220 1.6100 -0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2200 0.1620 -0.1980 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3700 -0.5280 -0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4270 0.0570 -0.1440 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3430 -2.0340 -0.0940 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5650 -2.4080 -0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0510 -2.4900 1.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -3.9750 1.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8910 -4.9220 2.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1650 -4.7900 3.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -5.9330 4.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4430 -7.1660 3.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1640 -7.3260 2.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3880 -6.1830 2.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0450 -5.9880 0.8300 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4850 -6.6820 0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9900 -4.6660 0.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5900 -4.0170 -0.7420 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5960 -4.4020 -0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7320 -4.3150 -1.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4440 -4.7870 -1.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3430 -5.0610 -2.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1590 -4.8630 -4.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4460 -4.3920 -4.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2360 -4.1230 -3.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0010 -3.4850 -3.4510 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 2.0430 -0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8800 1.9040 -1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8400 1.9680 0.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 -2.2780 1.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7110 -1.9690 2.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 -3.8340 3.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 -5.8690 5.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2500 -8.0310 4.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5360 -8.2920 2.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 -4.9400 -0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3490 -5.4290 -2.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4570 -5.0770 -5.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8380 -4.2380 -5.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6470 -2.5630 -0.5190 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3680 -2.3270 0.1470 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 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 40 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 17 2 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 40 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 24 2 0 0 0 0 23 38 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 25 26 1 0 0 0 0 40 41 1 0 0 0 0 M END