COMGENEX-ZINC06766825 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 -0.3140 3.0350 0.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4450 1.6910 0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3810 0.6350 0.9840 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4110 0.9800 1.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3510 -0.6580 0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0970 -1.6610 0.7230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8240 -0.6990 -1.0510 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 -1.9550 -1.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5730 -2.1220 -2.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8840 -1.9310 -2.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1840 0.4190 2.3180 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 0.6250 3.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9260 1.0320 3.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6770 1.2250 4.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1240 1.0160 5.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 0.6100 5.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 0.4120 4.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3640 -0.0220 4.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8980 -0.2200 5.8620 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0440 -0.1930 3.6340 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4640 0.0280 2.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1240 -0.1360 1.4360 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3830 -0.6050 3.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6940 -1.9580 3.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0140 -2.3610 3.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0260 -1.4200 3.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7210 -0.0710 3.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4010 0.3390 3.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9950 1.1080 3.7300 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -7.4660 -1.8630 3.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 3.3380 0.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 3.7870 0.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6790 2.9380 1.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4920 1.3880 0.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 1.7880 -0.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1830 0.1040 -1.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 -2.7890 -1.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 -3.0570 -3.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3480 -2.1390 -1.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7520 -1.2880 -3.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8590 -1.8120 -2.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8620 -2.8660 -3.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7050 -1.0970 -3.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 1.1980 2.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7060 1.5420 4.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7240 1.1710 6.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3840 0.4460 6.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9030 -2.6940 3.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2550 -3.4130 3.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1620 1.3920 3.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7850 -1.9440 4.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0890 -1.1330 3.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5640 -2.8340 3.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 11 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 37 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 15 16 2 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 2 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 M END