CHEMBRIDGE-ZINC02856858 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 0 0 0 0 0 0999 V2000 1.1440 -0.3420 -0.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -0.0250 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 1.0000 0.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9560 1.2770 1.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8540 2.1990 2.6140 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0850 0.5510 1.8100 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -0.4810 0.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2220 -0.8090 0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3880 -1.8740 -0.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5500 -2.5900 -0.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5740 -2.2660 0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4210 -1.2200 0.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7560 -3.0060 0.0470 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9430 -2.3810 0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0120 -0.6700 0.1960 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.0750 -3.1020 0.2910 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.3900 -2.4440 0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2920 -3.1200 -0.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3170 -4.5680 -0.4770 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.9840 -5.1610 -0.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0290 -4.5690 0.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2460 -5.1940 -1.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4030 -6.5060 -1.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.2820 -7.1350 -1.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0410 -6.4040 -2.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8510 -5.0320 -2.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9600 -4.4650 -2.1360 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9650 0.3550 -0.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4910 -1.3610 -0.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7930 -0.2510 -1.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0110 1.6000 0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5990 -2.1290 -1.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6780 -3.4110 -1.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2180 -0.9750 1.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7230 -3.9700 -0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8330 -2.5470 1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2760 -1.3890 0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3030 -2.7200 -0.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9030 -2.9280 -1.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0460 -6.2410 -0.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6130 -4.9400 -1.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0150 -4.9180 0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3380 -4.8800 1.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4050 -8.2050 -1.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7650 -6.8920 -3.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4270 -4.4340 -3.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 20 41 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 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 M END