IBS-ZINC02222533 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 0.2690 1.4340 0.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2620 0.0490 0.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2920 -0.6420 -0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2850 0.0680 -0.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2590 1.3860 -0.7730 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2950 2.0760 -0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3300 -2.1480 -0.0560 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4020 -2.5270 0.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4960 -2.6900 -1.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6730 -4.2100 -1.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9340 -4.5500 -0.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7830 -4.0290 0.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4670 -2.5950 0.7590 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2090 -1.7050 1.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7210 -0.0660 1.5320 S 0 0 0 0 0 0 0 0 0 0 0 0 4.3340 -2.1060 2.0720 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0180 -1.2430 2.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6190 -0.1030 2.9890 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2510 -1.6820 3.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9610 -0.7900 4.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1120 -1.2060 4.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5640 -2.5050 4.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8640 -3.3940 4.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7090 -2.9920 3.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1430 -3.0670 5.6910 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 2.0050 0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 -0.4800 1.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0910 -0.4630 -1.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3080 3.1540 -0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6110 -2.4480 -2.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3750 -2.2380 -1.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8050 -4.6590 -0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7670 -4.6010 -2.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0720 -5.6310 -0.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7990 -4.0800 -1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9760 -4.5630 1.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7160 -4.1810 1.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6530 -3.0150 1.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6100 0.2240 4.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6620 -0.5170 5.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2210 -4.4060 3.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1620 -3.6880 2.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 42 1 0 0 0 0 M END