IBS-ZINC04549320 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 -0.0610 2.1950 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0650 0.6720 -0.1670 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4360 0.3970 -1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 0.0390 1.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1240 0.2680 2.2360 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5520 -0.0840 2.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1800 0.5560 0.9610 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1860 1.6400 1.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 0.1980 -0.1920 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6160 0.0520 0.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4490 0.7920 3.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7050 1.1430 3.5110 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1290 1.6370 4.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2870 1.9760 4.8360 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0950 1.7490 5.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 2.2160 6.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 2.4110 7.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2300 2.5020 7.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3400 2.6840 8.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2090 2.7800 9.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9640 2.6920 9.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1650 2.5020 9.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3880 2.4110 9.7790 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3680 1.1340 4.9000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9670 2.5560 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5870 2.6440 -0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 2.4690 0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 -1.0320 0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6540 0.5000 1.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6620 -1.1670 2.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0430 0.2960 3.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1980 0.3220 1.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0620 0.5070 -0.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6090 -1.0320 0.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2080 2.4450 7.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3370 2.4290 6.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3180 2.7540 7.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0860 2.9230 10.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8710 2.7680 11.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8390 3.2600 9.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 24 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 23 40 1 0 0 0 0 M END