NIH-ZINC04388840 MOE2007 3D CORINA 3.40 0006 02.08.2006 69 72 0 0 1 0 0 0 0 0999 V2000 -0.0390 0.7650 0.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 -0.6690 -0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1050 -1.3630 -0.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 -0.7310 -1.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5310 -0.0620 -1.2620 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3720 1.0000 -1.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2770 -0.1760 -2.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9590 -1.2150 -2.9960 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4410 -0.8680 -4.2330 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0630 0.3580 -4.5630 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3390 0.7960 -3.5220 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7660 2.1230 -3.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7300 3.1650 -2.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0930 4.5290 -2.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4590 4.9560 -1.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8550 6.2150 -1.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8740 7.0660 -2.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5040 6.6430 -3.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1060 5.3780 -4.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4760 7.5340 -5.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1550 7.1770 -6.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3080 8.3170 -2.8210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 8.8190 -1.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5280 0.2370 0.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0370 -0.1020 1.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0530 -1.5330 1.9810 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1230 -2.4750 1.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6730 -2.0480 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8950 -1.9970 2.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8600 -3.3050 3.3080 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6770 -3.7320 4.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5320 -2.9090 4.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5030 -1.5950 4.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7040 -1.1220 3.6140 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8760 1.2440 0.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4470 1.3750 -0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7570 0.7810 1.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6890 -1.2200 0.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6400 -0.8570 -1.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9400 -2.4040 -0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7560 -1.3700 0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 -1.7800 -1.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6140 -0.2570 -2.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5030 2.3500 -4.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8270 2.0950 -2.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0700 2.8700 -1.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6390 3.2150 -3.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4310 4.3180 -0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3770 6.5020 -0.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5950 5.0320 -4.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0530 8.0100 -6.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2240 7.0240 -6.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7000 6.2950 -6.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3790 9.8330 -1.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 8.2160 -1.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4890 8.8820 -0.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2620 1.2970 0.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2800 0.0060 -0.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0350 0.3460 1.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3920 0.3910 2.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5580 -3.4770 1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2400 -2.5670 2.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4870 -2.1790 -0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8070 -2.6370 -0.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6160 -4.7920 4.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1790 -3.2700 5.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1390 -0.8550 5.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2840 -0.5770 -0.0310 N 0 3 0 0 0 0 0 0 0 0 0 0 2.6570 -0.4480 0.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 38 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 3 41 1 0 0 0 0 4 5 1 0 0 0 0 4 42 1 0 0 0 0 4 43 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 68 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 13 46 1 0 0 0 0 13 47 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 16 49 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 50 1 0 0 0 0 20 21 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 21 53 1 0 0 0 0 22 23 1 0 0 0 0 23 54 1 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 24 25 1 0 0 0 0 24 57 1 0 0 0 0 24 58 1 0 0 0 0 24 68 1 0 0 0 0 25 26 1 0 0 0 0 25 59 1 0 0 0 0 25 60 1 0 0 0 0 26 27 1 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 61 1 0 0 0 0 27 62 1 0 0 0 0 28 63 1 0 0 0 0 28 64 1 0 0 0 0 28 68 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 31 32 1 0 0 0 0 31 65 1 0 0 0 0 32 33 2 0 0 0 0 32 66 1 0 0 0 0 33 34 1 0 0 0 0 33 67 1 0 0 0 0 68 69 1 0 0 0 0 M CHG 1 68 1 M END