ANALYTICONDISCOVERY-ZINC04221522 MOE2007 3D CORINA 3.40 0006 02.08.2006 82 86 0 0 1 0 0 0 0 0999 V2000 0.0220 -3.6130 -1.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.4670 -0.7490 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -2.5350 0.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 -1.2770 1.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -0.3860 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -1.1430 -1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 -0.6300 -2.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -1.3970 -3.4350 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2820 0.6900 -2.7150 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2270 1.2160 -4.0810 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4880 0.6580 -4.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 2.7310 -4.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5260 3.2280 -5.3950 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2310 3.2740 -6.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5710 2.2630 -5.7660 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6310 1.2100 -4.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3460 2.3290 -6.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2080 3.2430 -7.6510 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3830 1.2660 -7.1230 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8950 0.2940 -7.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3850 1.2410 -5.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4380 0.1620 -6.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1730 0.4710 -7.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1710 0.4960 -8.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1180 1.5750 -8.4290 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4040 1.5920 -9.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7920 2.9180 -8.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0370 3.3870 -7.2280 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1230 3.5990 -9.4350 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8040 3.1930 -10.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8700 3.8950 -11.6930 C 0 0 3 0 0 0 0 0 0 0 0 0 6.8070 3.3390 -11.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0280 5.2550 -10.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8560 4.8720 -9.4760 C 0 0 3 0 0 0 0 0 0 0 0 0 6.8340 4.7520 -9.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0710 5.9390 -8.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0040 5.6700 -8.2570 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3820 4.0880 -13.0600 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5300 3.1070 -13.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9830 2.0280 -13.6390 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1470 3.3410 -15.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7130 4.5340 -15.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4580 4.3060 -17.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7350 3.0060 -17.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1600 2.4100 -16.3830 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5620 1.0070 -16.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1330 4.5910 -5.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3200 4.7550 -5.3450 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0040 -3.9120 -1.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 -3.3340 -2.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5540 -4.4440 -1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0670 -3.4440 1.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 -1.0100 2.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 0.6920 0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4350 1.2900 -1.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1890 2.8860 -4.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3440 3.2260 -3.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 1.4460 -3.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8310 0.2410 -5.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8720 2.2130 -5.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8610 1.0210 -5.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1510 0.1440 -5.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9500 -0.8100 -6.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6600 1.4430 -7.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9230 -0.2980 -7.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6950 0.7160 -9.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6830 -0.4760 -8.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8800 2.1100 -10.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8040 3.5310 -11.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0160 5.6770 -11.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2480 5.9510 -11.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9510 4.9200 -13.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5920 5.4690 -15.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1040 5.0360 -17.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6370 2.5240 -18.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6840 0.3950 -16.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0310 0.6750 -17.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2720 0.9090 -15.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5570 7.1880 -8.6720 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3550 5.6250 -4.8280 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7900 6.4800 -4.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0170 7.8370 -8.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 49 1 0 0 0 0 1 50 1 0 0 0 0 1 51 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 3 52 1 0 0 0 0 4 5 1 0 0 0 0 4 53 1 0 0 0 0 5 6 2 0 0 0 0 5 54 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 55 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 56 1 0 0 0 0 12 57 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 47 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 58 1 0 0 0 0 16 59 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 25 1 0 0 0 0 21 22 1 0 0 0 0 21 60 1 0 0 0 0 21 61 1 0 0 0 0 22 23 1 0 0 0 0 22 62 1 0 0 0 0 22 63 1 0 0 0 0 23 24 1 0 0 0 0 23 64 1 0 0 0 0 23 65 1 0 0 0 0 24 25 1 0 0 0 0 24 66 1 0 0 0 0 24 67 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 34 1 0 0 0 0 30 31 1 0 0 0 0 30 68 1 0 0 0 0 30 69 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 38 1 0 0 0 0 33 34 1 0 0 0 0 33 70 1 0 0 0 0 33 71 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 36 37 2 0 0 0 0 36 79 1 0 0 0 0 38 39 1 0 0 0 0 38 72 1 0 0 0 0 39 40 2 0 0 0 0 39 41 1 0 0 0 0 41 42 2 0 0 0 0 41 45 1 0 0 0 0 42 43 1 0 0 0 0 42 73 1 0 0 0 0 43 44 2 0 0 0 0 43 74 1 0 0 0 0 44 45 1 0 0 0 0 44 75 1 0 0 0 0 45 46 1 0 0 0 0 46 76 1 0 0 0 0 46 77 1 0 0 0 0 46 78 1 0 0 0 0 47 48 2 0 0 0 0 47 80 1 0 0 0 0 79 82 1 0 0 0 0 80 81 1 0 0 0 0 M END