IBS-ZINC02160418 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.7430 -0.5450 1.2420 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0350 -1.0890 1.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8480 -1.4390 0.8900 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4910 -0.9780 -0.3710 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1240 -0.1020 -0.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0110 -0.6310 -1.4020 S 0 0 0 0 0 0 0 0 0 0 0 0 3.2520 -2.1620 -0.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8620 -2.4440 -2.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5160 -3.6520 -2.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5570 -4.5790 -1.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9420 -4.3110 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2760 -3.0980 0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -2.5560 1.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4690 -3.0370 2.3850 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2920 0.6180 2.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4610 0.9240 1.9220 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4840 1.3180 2.8490 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 2.4480 3.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 3.0550 4.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3100 2.5940 5.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3180 3.1490 6.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0990 4.1650 5.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8720 4.6300 4.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 4.0750 3.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6390 5.6300 4.1870 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6630 6.1560 5.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4220 -0.5610 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8310 -1.7230 -2.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9940 -3.8710 -3.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0730 -5.5170 -1.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9770 -5.0370 0.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 1.0730 2.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8180 2.1000 4.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4090 3.1990 2.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2990 1.7990 6.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4950 2.7860 7.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8870 4.5980 6.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 4.4380 2.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3580 5.3600 5.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2120 6.5640 5.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2000 6.9450 4.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9140 -0.1990 -0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3850 -1.6500 -0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9800 -0.2300 0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 17 1 0 0 0 0 5 6 1 0 0 0 0 5 15 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 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 12 13 2 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 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 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 40 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 26 43 1 0 0 0 0 27 28 1 0 0 0 0 28 44 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 M END