ANALYTICONDISCOVERY-ZINC08254010 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 72 0 0 1 0 0 0 0 0999 V2000 -1.6330 0.0050 0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 -1.0730 0.1060 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 -0.7860 -0.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0470 0.5140 -0.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3890 0.7450 -0.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2800 -0.3180 -0.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8260 -1.6150 -0.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4770 -1.8860 -0.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0790 -3.1940 -0.1100 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1050 -3.7670 -0.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0640 -4.3100 0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3850 -5.1960 1.2790 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 -4.6230 1.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8110 -4.0780 0.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9470 -6.4340 1.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9120 -6.8720 0.9330 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3570 -7.2380 2.7180 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7230 -7.3140 2.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6220 -6.5160 4.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4450 -8.0610 4.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3520 -8.7190 3.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8980 -8.6950 2.8060 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8370 -9.1980 1.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0470 -9.4520 3.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 -8.6700 5.1780 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9440 -8.1530 5.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2300 -9.5520 6.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1590 -8.7940 7.6490 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6100 -9.0220 8.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2910 -7.9800 9.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6430 -7.1780 8.9830 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9200 -7.6930 7.7960 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8000 -7.6680 10.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5610 -6.3490 10.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0470 -6.1360 12.3010 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5080 -5.2780 12.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3360 0.7220 0.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7580 0.4940 -0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6040 -0.4100 0.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3880 1.3760 -0.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7360 1.7570 -1.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3250 -0.1430 -1.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5370 -2.4350 -0.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6230 -3.0600 -1.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2230 -4.5950 -1.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4860 -3.4860 0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9020 -4.8190 -0.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5240 -3.8090 2.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -5.3510 2.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2340 -4.9090 0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6400 -3.5690 1.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2850 -6.0530 4.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4050 -5.7520 3.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1250 -7.2020 4.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7730 -8.7570 5.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7070 -9.7550 3.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0360 -8.2210 2.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4480 -10.4630 3.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9780 -9.5790 3.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -10.0610 6.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5480 -10.3230 6.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2890 -9.8580 8.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 -7.6300 11.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4510 -8.4750 11.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4140 -6.3660 10.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 -5.5100 10.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0680 -7.5510 5.0670 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.1440 -7.1000 6.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 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 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 6 7 2 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 44 1 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 11 46 1 0 0 0 0 11 47 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 48 1 0 0 0 0 13 49 1 0 0 0 0 14 50 1 0 0 0 0 14 51 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 22 1 0 0 0 0 19 52 1 0 0 0 0 19 53 1 0 0 0 0 19 67 1 0 0 0 0 20 21 1 0 0 0 0 20 54 1 0 0 0 0 20 55 1 0 0 0 0 20 67 1 0 0 0 0 21 22 1 0 0 0 0 21 56 1 0 0 0 0 21 57 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 58 1 0 0 0 0 24 59 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 67 1 0 0 0 0 27 28 1 0 0 0 0 27 60 1 0 0 0 0 27 61 1 0 0 0 0 28 29 1 0 0 0 0 28 32 1 0 0 0 0 29 30 2 0 0 0 0 29 62 1 0 0 0 0 30 31 1 0 0 0 0 30 33 1 0 0 0 0 31 32 2 0 0 0 0 33 34 1 0 0 0 0 33 63 1 0 0 0 0 33 64 1 0 0 0 0 34 35 1 0 0 0 0 34 65 1 0 0 0 0 34 66 1 0 0 0 0 35 36 1 0 0 0 0 67 68 1 0 0 0 0 M CHG 1 67 1 M END