IBS-ZINC02445730 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 -0.1540 1.4700 0.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1150 -0.0350 0.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 -0.7830 1.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 -2.1640 1.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0430 -2.8010 0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -2.0540 -0.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0710 -0.6660 -0.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -2.6950 -2.2100 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9540 -4.0010 -2.5070 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.6960 -4.3980 -3.8460 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8050 -4.8730 -1.3950 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6200 -3.4280 -2.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2200 -2.9770 -3.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5260 -2.5270 -3.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2360 -2.5290 -2.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6300 -2.9840 -1.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3260 -3.4370 -1.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5560 -2.0750 -2.3820 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7170 -2.9530 -1.5920 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.2140 -3.1990 -0.2860 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9540 -2.2980 -1.8390 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8170 -4.5220 -2.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1740 -5.6240 -2.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4070 -6.7410 -2.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2400 -6.5460 -3.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7860 -4.8740 -3.8140 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.7590 -7.8670 -5.0580 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.8630 1.8580 0.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 1.8620 -0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 1.7760 1.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1650 -0.2870 2.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1010 -2.7440 2.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 -3.8800 0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0650 -0.0820 -1.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 -2.3750 -2.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6670 -2.9750 -4.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9940 -2.1740 -4.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1800 -2.9870 -0.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8560 -3.7950 -0.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7940 -1.2450 -2.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5210 -5.6420 -1.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9500 -7.6980 -2.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 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 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 M END