IBS-ZINC01310227 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 36 0 0 1 0 0 0 0 0999 V2000 -0.1170 1.1580 -0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1620 -0.2690 -0.0530 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6340 -1.1190 1.0590 P 0 0 3 0 0 0 0 0 0 0 0 0 2.0700 -0.7660 1.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4340 -2.8900 0.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3050 -4.0360 0.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 -5.4350 0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7500 -6.3780 1.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 -7.7240 0.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1570 -8.1390 -0.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7570 -7.2090 -1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6140 -5.8600 -0.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 -0.7340 2.7110 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0160 0.3410 2.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -1.4490 3.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8200 -0.7960 4.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5650 -1.4510 5.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2670 -2.7600 5.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -3.4130 5.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4750 -2.7560 4.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2860 -3.6570 7.0020 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.3950 -1.1650 2.7860 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9200 1.4860 -0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6640 1.4970 -1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5730 1.5800 0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3380 -6.0560 1.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0610 -8.4550 1.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2760 -9.1940 -0.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3420 -7.5390 -1.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0860 -5.1350 -1.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0530 0.2260 4.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3800 -0.9410 5.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9900 -4.4350 5.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3420 -3.2640 3.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5160 -2.1140 2.6430 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 3 4 2 0 0 0 0 3 5 1 0 0 0 0 3 13 1 0 0 0 0 5 6 3 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 10 11 2 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 22 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 20 34 1 0 0 0 0 22 35 1 0 0 0 0 M END