ANALYTICONDISCOVERY-ZINC05413352 MOE2007 3D CORINA 3.40 0006 02.08.2006 72 75 0 0 1 0 0 0 0 0999 V2000 -4.9170 3.8150 4.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0900 3.0950 3.8020 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6510 2.0310 3.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9040 1.2860 2.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4770 0.2060 1.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7930 -0.1330 1.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5390 0.6080 2.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9690 1.6850 3.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4150 -1.3120 1.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1950 -2.5770 2.0100 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.5790 -2.4190 3.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9210 -3.7320 1.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3050 -4.7060 1.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2520 -3.6800 1.2060 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.8850 -4.8290 0.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7630 -2.8760 2.0740 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2690 -3.5890 3.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0110 -3.9830 3.9810 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7950 -3.8970 3.1730 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3180 -3.6070 2.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5930 -5.3980 3.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1790 -5.6370 3.7300 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5710 -4.9000 4.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7730 -3.3980 4.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1870 -3.1560 4.2860 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9120 -2.2730 5.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0960 -2.1220 4.7600 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2770 -1.4970 6.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3800 -0.1440 6.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6810 0.3250 7.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0270 -0.6080 8.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2650 -2.1570 7.3470 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.4530 -6.5180 3.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9460 -7.0720 2.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 -6.8130 3.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7110 -7.4320 2.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1390 -7.7860 2.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4380 -8.1440 4.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9880 -7.8000 4.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3480 4.6370 5.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7830 4.2130 4.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2520 3.1460 5.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8760 1.5510 2.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8960 -0.3740 0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5670 0.3410 2.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5510 2.2610 4.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4840 -1.1390 1.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9520 -1.4380 0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4720 -4.9740 -0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7000 -5.7170 1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9590 -4.6570 0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1690 -2.5610 1.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2170 -5.7240 4.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8630 -5.9510 2.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0510 -5.1900 5.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4950 -5.1220 4.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5030 -2.8460 5.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1500 -3.0720 3.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9540 0.4920 5.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6610 1.3710 7.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4320 -0.4090 8.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4680 -5.8880 3.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 -8.3350 1.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7400 -6.7170 1.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6640 -8.2400 1.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6620 -6.8800 2.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9640 -7.2360 5.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4520 -8.8580 5.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5010 -7.3480 5.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4580 -8.7090 4.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1000 -8.7330 3.7550 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 -9.5970 3.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 1 42 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 43 1 0 0 0 0 5 6 1 0 0 0 0 5 44 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 45 1 0 0 0 0 8 46 1 0 0 0 0 9 10 1 0 0 0 0 9 47 1 0 0 0 0 9 48 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 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 49 1 0 0 0 0 15 50 1 0 0 0 0 15 51 1 0 0 0 0 16 17 1 0 0 0 0 16 52 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 53 1 0 0 0 0 21 54 1 0 0 0 0 22 23 1 0 0 0 0 22 33 1 0 0 0 0 23 24 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 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 2 0 0 0 0 28 32 1 0 0 0 0 29 30 1 0 0 0 0 29 59 1 0 0 0 0 30 31 2 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 33 34 2 0 0 0 0 33 35 1 0 0 0 0 35 36 1 0 0 0 0 35 39 1 0 0 0 0 35 62 1 0 0 0 0 36 37 1 0 0 0 0 36 63 1 0 0 0 0 36 64 1 0 0 0 0 37 65 1 0 0 0 0 37 66 1 0 0 0 0 37 71 1 0 0 0 0 38 39 1 0 0 0 0 38 67 1 0 0 0 0 38 68 1 0 0 0 0 38 71 1 0 0 0 0 39 69 1 0 0 0 0 39 70 1 0 0 0 0 71 72 1 0 0 0 0 M END