CHEMBRIDGE-ZINC04951647 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 0 0 0 0 0 0999 V2000 -0.1190 1.5030 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -0.0020 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 -0.6540 1.1220 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 0.0440 2.3360 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2910 -0.6320 3.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3540 -1.8450 3.4870 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3620 0.1050 4.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5020 -0.5760 5.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5640 0.1520 7.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4940 1.4680 7.1480 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3620 2.1490 6.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2970 1.5020 4.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 -0.7310 -1.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 -0.0800 -2.3860 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 1.3220 -2.3950 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1600 -2.2370 -1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8710 1.9190 -0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8070 1.8360 -0.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 1.8420 0.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 1.0120 2.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5590 -1.6540 6.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 -0.3650 8.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3090 3.2270 6.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1940 2.0660 3.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 1.7190 -3.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1980 -2.5670 -1.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3090 -2.6150 -2.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3740 -2.6190 -0.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 2 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 20 1 0 0 0 0 5 6 2 0 0 0 0 5 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 8 21 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 23 1 0 0 0 0 12 24 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 15 25 1 0 0 0 0 16 26 1 0 0 0 0 16 27 1 0 0 0 0 16 28 1 0 0 0 0 M END