COMGENEX-ZINC04793817 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 1 0 0 0 0 0999 V2000 0.1940 1.0090 1.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -0.0750 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3930 -0.5780 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3460 0.0300 -0.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 -0.4260 -0.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0030 -1.5030 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0360 -2.1120 0.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7370 -1.6500 0.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3960 -1.9970 0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0140 -2.1000 -0.9990 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9820 -2.3320 1.2090 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3180 -2.9440 1.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2270 -2.1150 2.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5690 -1.9650 3.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2180 -1.2700 3.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2940 -2.0980 2.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5480 -3.1600 5.6260 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.6660 -2.6660 6.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8130 -2.3050 5.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6640 -1.0100 4.6200 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.7000 -4.5260 6.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6980 -5.5130 5.5390 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8380 -4.6500 7.5780 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.9860 -5.9780 8.1790 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.3870 -6.6980 7.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4570 -6.3960 8.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5100 -5.9370 9.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0090 -5.6410 9.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 1.3730 1.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4850 1.8340 0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 0.5920 2.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2560 0.3420 -0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -0.9000 0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0700 0.8640 -1.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3910 0.0500 -1.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3050 -2.9460 1.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9870 -2.1220 1.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7280 -2.9550 0.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2480 -3.9630 1.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3820 -1.1290 1.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1870 -2.6190 2.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3560 -0.2760 2.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7700 -1.1800 4.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0710 -3.0540 2.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3680 -1.5510 2.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7220 -2.8920 5.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7730 -1.8690 6.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8390 -3.8600 8.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5670 -7.3840 8.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0560 -5.6760 8.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7960 -6.4260 7.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0470 -5.1550 10.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7020 -6.9000 10.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6700 -5.6110 10.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4710 -6.4220 9.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8170 -4.6780 9.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4210 -3.2810 4.1600 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.0880 -3.9430 3.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 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 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 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 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 14 57 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 21 1 0 0 0 0 17 57 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 57 58 1 0 0 0 0 M END