CHEMBRIDGE-ZINC04688191 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 61 0 0 0 0 0 0 0 0999 V2000 -0.2030 1.3340 0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 -0.0950 0.1080 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4860 -0.6990 1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5600 -2.0830 1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -2.6970 2.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8140 -1.9290 3.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7400 -0.5440 3.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0820 0.0690 2.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4850 -2.5500 4.2920 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0320 -1.5560 5.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5970 -2.2720 6.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5540 -3.2940 6.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1200 -4.2430 4.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5350 -3.4500 3.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7950 -3.3590 6.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1730 -2.5020 7.3020 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6930 -4.4670 6.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2700 -5.7920 6.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1150 -6.8230 5.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3840 -6.5550 5.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8160 -5.2530 5.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9760 -4.1990 5.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4060 -2.8870 5.5040 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6070 -2.6300 6.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0010 -1.1580 6.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0450 -1.0990 3.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6500 -2.5720 4.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6650 -8.2250 6.1000 N 0 3 0 0 0 0 0 0 0 0 0 0 5.5510 -8.4650 6.5300 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4090 -9.1400 5.7930 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8140 1.7240 0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7520 1.6860 -0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 1.6810 1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -2.6800 0.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2800 -3.7750 2.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2000 0.0550 3.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0270 1.1470 2.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8280 -0.9960 4.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2420 -0.8720 5.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1060 -1.5520 7.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7860 -2.7480 7.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9750 -4.8270 4.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3590 -4.9090 5.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1080 -4.1390 3.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3230 -2.8630 3.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2830 -6.0060 6.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0380 -7.3710 5.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8060 -5.0520 4.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3980 -2.8590 7.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4240 -3.2590 5.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1950 -0.5300 6.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9080 -0.9710 6.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2540 -0.8700 2.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2270 -0.4710 4.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4570 -3.2000 3.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7430 -2.7580 3.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2450 -0.8420 4.7660 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5580 0.1110 4.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 16 2 0 0 0 0 15 17 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 46 1 0 0 0 0 19 20 1 0 0 0 0 19 28 1 0 0 0 0 20 21 2 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 25 57 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 26 57 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 28 1 M CHG 1 30 -1 M END