CHEMBRIDGE-ZINC00758777 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 52 0 0 0 0 0 0 0 0999 V2000 -0.0110 1.2160 0.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 0.1050 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -0.5170 -0.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 -0.0220 0.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3640 1.1000 1.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 1.7120 1.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6950 -0.6830 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7400 -1.8890 -0.1880 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9300 0.1200 -0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8620 1.5160 -0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0170 2.2640 -0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2450 1.6370 -0.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3230 0.2500 -0.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1700 -0.5110 -0.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5700 -0.3800 -0.4710 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7500 -1.7130 -0.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8720 -2.5480 -0.4240 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1980 -1.9910 -0.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9550 -3.1490 -0.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3310 -3.0670 -0.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9610 -1.8230 -0.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2050 -0.6500 -0.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8280 -0.7300 -0.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7440 0.2690 -0.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8880 1.4750 -0.5890 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4330 -1.7460 -1.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9830 -0.6630 -1.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 15.1630 -2.8760 -1.0810 N 0 0 0 0 0 0 0 0 0 0 0 0 16.5450 -2.8030 -1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3380 -3.8250 -1.2830 N 0 0 0 0 0 0 0 0 0 0 0 0 18.6280 -3.5720 -1.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9400 -2.2750 -1.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4460 -1.3520 -1.2830 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9520 1.7020 1.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8920 -0.2770 -0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 -1.3840 -0.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2740 1.4870 1.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1230 2.5790 1.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9060 2.0090 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9630 3.3420 -0.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1460 2.2280 -0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2300 -1.5900 -0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4720 -4.1140 -0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9200 -3.9700 -0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6920 0.3130 -0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7240 -3.7400 -1.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 19.3720 -4.3520 -1.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 19.9350 -1.8630 -1.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 12 13 2 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 24 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 23 2 0 0 0 0 19 20 2 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 29 30 2 0 0 0 0 29 33 1 0 0 0 0 30 31 1 0 0 0 0 31 32 2 0 0 0 0 31 47 1 0 0 0 0 32 33 1 0 0 0 0 32 48 1 0 0 0 0 M END