IBS-ZINC04844113 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 29 0 0 0 0 0 0 0 0999 V2000 -0.1640 -0.2100 1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4970 -0.0720 -0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5500 0.7660 -0.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2680 0.7820 -1.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9380 0.0440 -2.4820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -0.8440 -1.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5610 -0.1940 -2.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8000 1.2510 -2.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7240 2.0240 -3.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9510 3.3820 -3.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2540 3.9820 -2.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3320 3.2250 -1.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1130 1.8660 -1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5620 5.8460 -2.1820 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -2.3120 -1.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2260 -2.9470 -2.3180 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9040 0.5820 1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6560 -1.1800 1.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5880 -0.1300 1.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8410 1.4220 0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8250 -0.7500 -3.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 1.5580 -4.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8920 3.9790 -4.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5680 3.7010 -0.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1780 1.2760 -0.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3180 1.6160 -1.7270 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5590 -2.9530 -0.2400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 -3.9100 -0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7440 1.5550 -2.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 6 7 2 0 0 0 0 6 15 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 22 1 0 0 0 0 10 11 1 0 0 0 0 10 23 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 24 1 0 0 0 0 13 25 1 0 0 0 0 15 16 2 0 0 0 0 15 27 1 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 M END