IBS-ZINC04973921 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 0 0 0 0 0 0999 V2000 0.2110 1.2820 0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 -0.2240 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3450 -0.5930 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1990 -0.6740 -1.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3710 -1.0380 -0.6010 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3090 -1.1890 0.6740 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0920 -0.9340 1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5300 -1.0140 2.7680 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.0600 -1.5220 3.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8130 -1.6580 5.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7110 -1.4340 5.5250 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8170 -2.0290 5.8900 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5870 -2.1560 7.2660 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5580 -2.5150 8.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3260 -2.6430 9.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3040 -3.1140 10.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6410 -3.3640 9.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7430 -3.7290 10.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8010 -3.8590 9.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3070 -3.5720 8.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0040 -3.2690 8.4250 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9900 -2.2550 10.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8610 -0.4020 -2.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7010 -0.8510 -3.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3800 -0.5940 -4.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2280 0.1070 -5.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3910 0.5550 -4.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7040 0.3090 -2.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 1.5570 0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3170 1.8220 -0.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2170 1.5400 1.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5010 -0.4810 -0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 -0.7640 0.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8320 -0.7720 3.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3890 -2.4800 3.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6990 -2.2090 5.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5400 -2.7140 7.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0970 -3.3050 11.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7900 -3.8870 11.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8190 -4.1370 9.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8680 -3.5810 7.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0100 -1.2030 10.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7850 -2.8660 10.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2110 -2.4150 9.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6000 -1.3990 -3.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0290 -0.9400 -5.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9810 0.3060 -6.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5070 1.1020 -4.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 0.6630 -2.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 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 23 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 22 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 21 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 2 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 M END