IBS-ZINC05461642 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 34 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.8220 1.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -2.1320 0.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -2.1030 -0.6680 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -2.8740 -1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -0.7610 -1.0660 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -3.3350 1.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1990 -3.3880 2.8350 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 -4.5960 3.2570 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2570 -5.3920 2.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3570 -4.6200 1.1420 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6910 -5.0450 -0.1510 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9330 -5.0630 -0.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2850 -5.5100 -1.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 -5.5310 -2.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9420 -5.9510 -3.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9460 -6.3520 -4.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6210 -6.3350 -4.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2840 -5.9220 -2.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 -5.9060 -2.2290 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.5280 -7.1300 2.3710 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -0.4910 2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7080 -4.7500 0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3990 -5.2180 -1.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9750 -5.9670 -3.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2050 -6.6800 -5.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8490 -6.6490 -4.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7750 -7.5980 2.1040 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 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 27 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 28 1 0 0 0 0 17 18 1 0 0 0 0 17 29 1 0 0 0 0 18 19 2 0 0 0 0 18 30 1 0 0 0 0 19 20 1 0 0 0 0 19 31 1 0 0 0 0 20 21 1 0 0 0 0 22 32 1 0 0 0 0 M END