CHEMBRIDGE-ZINC04819797 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 1 0 0 0 0 0999 V2000 -0.0150 1.5080 0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.0010 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8190 -0.6970 1.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5810 -1.6380 -0.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5350 -2.3250 -1.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7820 -3.4850 -1.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0740 -3.9690 -2.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1270 -3.2990 -1.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8900 -2.1280 -0.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0080 -1.4110 -0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7820 -0.3150 0.5020 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7630 0.3140 1.0570 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5360 1.4190 1.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3190 2.0120 1.9320 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2250 3.1270 2.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1710 3.6910 2.8410 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5450 3.6380 3.1670 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.5380 3.6620 4.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7520 2.4160 2.5540 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.8520 5.0260 2.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1080 5.5620 3.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0300 6.3060 4.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1820 6.7980 4.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4130 6.5450 4.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4910 5.7990 3.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3380 5.3130 2.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8600 7.1610 5.1420 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0060 1.8890 0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5980 2.0060 -0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4630 1.7040 1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4480 -0.1950 -0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8300 -1.7710 0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8400 -0.3160 1.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3710 -0.5020 2.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4750 -1.9540 -1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -4.0160 -2.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2570 -4.8760 -2.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1330 -3.6800 -1.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0140 -1.7910 -0.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5200 1.6130 1.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0210 5.6980 2.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9930 4.9560 1.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0690 6.5040 4.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1200 7.3790 5.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4520 5.6010 2.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3980 4.7350 1.7480 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 4 1 0 0 0 0 2 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 9 2 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 M END