NIH-ZINC04167199 MOE2007 3D CORINA 3.40 0006 02.08.2006 66 68 0 0 0 0 0 0 0 0999 V2000 1.6210 1.0930 -0.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4060 -0.4050 -0.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8620 -0.8560 0.8340 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7180 -2.1880 1.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2740 -3.0030 0.2540 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1580 -2.5430 2.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9580 -3.8610 2.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3470 -4.2460 4.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9530 -3.3100 4.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1360 -1.9880 4.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7480 -1.6100 3.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4290 -3.7860 6.6110 S 0 0 0 0 0 0 0 0 0 0 0 0 3.3960 -2.5910 7.4270 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6510 -4.9560 6.9580 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0480 -4.2540 6.3900 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1230 -3.2340 6.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6750 -3.1130 4.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9310 -5.4540 4.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3790 -5.5770 5.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7790 -4.4130 2.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8920 -5.4570 2.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1740 -6.0760 3.9220 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5030 -5.5690 1.6560 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5290 -6.4560 1.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9710 -7.2930 2.1370 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9930 -6.2920 0.0660 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0690 -7.1170 -0.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8540 -6.3370 -1.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9470 -7.1930 -2.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3820 -8.4900 -2.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5960 -9.2730 -1.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5030 -8.4200 -1.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6800 1.3380 -0.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2870 1.4860 -1.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0730 1.6030 0.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3410 -0.6340 -0.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9780 -0.9040 -1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4780 -4.5900 2.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1610 -5.2650 4.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5650 -1.2450 5.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8990 -0.5770 2.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7740 -2.2540 6.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9280 -3.5270 6.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9330 -2.7140 4.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5640 -2.4750 4.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3070 -6.4200 4.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1730 -5.0820 3.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1260 -6.0550 6.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5070 -6.2380 5.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2300 -3.4210 2.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0250 -4.5720 2.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1920 -4.9740 0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5820 -5.6000 -0.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7490 -7.3680 0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1730 -5.9790 -2.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3040 -5.4440 -1.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4450 -6.6260 -2.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7100 -7.4280 -1.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7270 -8.2590 -3.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1990 -9.1090 -3.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1480 -10.1600 -2.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2810 -9.6300 -0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0030 -8.9990 -0.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7350 -8.1900 -1.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0880 -4.4700 4.3300 N 0 3 0 0 0 0 0 0 0 0 0 0 7.8170 -4.8600 4.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 2 0 0 0 0 12 14 2 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 17 65 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 18 65 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 20 65 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 27 28 1 0 0 0 0 27 32 1 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 29 30 1 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 30 31 1 0 0 0 0 30 59 1 0 0 0 0 30 60 1 0 0 0 0 31 32 1 0 0 0 0 31 61 1 0 0 0 0 31 62 1 0 0 0 0 32 63 1 0 0 0 0 32 64 1 0 0 0 0 65 66 1 0 0 0 0 M CHG 1 65 1 M END