NIH-ZINC04056428 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 0 0 0 0 0 0999 V2000 -0.9360 3.3010 -0.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 1.9780 -0.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4100 0.9710 -0.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9240 1.2850 -0.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3300 2.6140 -0.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3950 3.6220 -0.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6780 2.9360 -0.3370 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2100 3.6580 -1.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7240 3.8320 -1.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9870 4.4680 -0.0420 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3730 3.8790 1.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8730 3.7030 0.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7710 5.5600 0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3420 5.9790 -0.9370 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9380 6.2620 1.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3070 7.7270 1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4420 8.4460 2.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4030 7.7110 3.3080 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1910 6.2740 3.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0480 5.5800 2.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7000 8.4870 3.9830 S 0 0 0 0 0 0 0 0 0 0 0 0 9.6820 7.4900 4.2280 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9420 9.6360 3.1820 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1900 9.0800 5.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3400 8.2890 6.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9250 8.7970 7.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3770 10.0650 7.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2490 10.7890 6.8690 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6390 10.3410 5.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0890 0.0220 -0.2620 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.6640 4.0840 -1.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3800 1.7300 -1.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7280 -0.0610 -0.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7080 4.6550 -0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0020 3.0900 -2.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7360 4.6370 -1.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2100 2.8570 -1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1060 4.4640 -2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8260 2.9080 1.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5240 4.5430 2.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4040 4.6820 0.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4210 3.1680 1.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0030 6.2110 1.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2550 7.7790 0.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5270 8.2060 0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8010 9.4620 2.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4720 8.4730 2.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0450 5.8580 4.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2830 6.1250 4.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7950 4.5310 2.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9890 5.6520 1.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7710 7.3010 6.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0270 8.2080 8.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0500 10.4670 8.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5230 10.9650 4.8180 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 27 28 2 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 29 55 1 0 0 0 0 M END