CHEMBRIDGE-ZINC04739194 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 0 0 0 0 0 0999 V2000 -0.0110 1.2990 0.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1050 -0.2100 0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 -0.6430 -1.0750 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8160 -1.9480 -1.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1730 -3.0170 -0.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2590 -4.3620 -1.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 -4.6270 -2.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6860 -3.6050 -3.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5750 -2.2770 -2.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2730 -1.2420 -3.4570 N 0 3 0 0 0 0 0 0 0 0 0 0 2.7730 -1.5810 -4.5400 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3270 -0.0870 -3.0020 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.3910 -5.3790 -0.5970 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2070 -6.7130 -0.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 -7.1860 1.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7770 -5.6540 1.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7350 -5.2000 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3460 -7.5880 2.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0250 1.6120 0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3720 1.8100 -0.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6140 1.6340 1.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 -0.6860 0.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1550 -0.4860 -0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2270 0.0710 -1.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3940 -2.7950 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 -5.6400 -2.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2660 -3.8690 -3.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3390 -7.4160 -1.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2570 -6.7310 -0.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4610 -8.2340 1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7970 -6.5670 1.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1440 -5.0220 2.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8050 -5.6470 1.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0980 -4.1690 -0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4360 -5.8070 -0.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7130 -6.9640 3.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0070 -8.6280 2.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3920 -7.5340 3.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2590 -7.0830 1.5600 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.8650 -7.6900 0.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 13 1 0 0 0 0 7 8 2 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 14 29 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 16 39 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 39 40 1 0 0 0 0 M CHG 1 10 1 M CHG 1 12 -1 M CHG 1 39 1 M END