CHEMBRIDGE-ZINC02894317 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 39 0 0 1 0 0 0 0 0999 V2000 -1.4920 -0.2790 -0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -0.0890 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4960 -0.8680 1.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7370 -0.6070 -1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2300 -0.2920 -1.0910 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6270 -0.7190 -0.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9540 -0.8850 -2.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5710 -0.1660 -3.0290 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9160 -2.2150 -2.4860 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4240 1.1600 -1.0790 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5230 1.6890 -0.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3550 0.9610 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7180 3.1550 -0.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8560 3.7060 0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0320 5.0740 0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0840 5.9000 -0.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9540 5.3600 -1.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7690 3.9930 -1.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9450 6.2510 -1.6760 N 0 3 0 0 0 0 0 0 0 0 0 0 2.1100 7.4580 -1.6640 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9500 5.7770 -2.1950 O 0 5 0 0 0 0 0 0 0 0 0 0 6.2380 5.6600 0.7320 N 0 3 0 0 0 0 0 0 0 0 0 0 7.0730 4.9340 1.2410 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3950 6.8680 0.7390 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.8480 0.3450 -0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7050 -1.3250 -0.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9990 0.0090 0.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2370 0.9700 0.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2750 -1.9270 1.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5710 -0.7320 1.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -0.4990 2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 -1.6850 -1.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3260 -0.1220 -2.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4230 -2.7900 -1.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3820 -2.5970 -3.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7600 1.7410 -1.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5970 3.0620 0.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2260 6.9700 -0.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8880 3.5730 -1.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 10 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 22 1 0 0 0 0 16 17 2 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M CHG 1 22 1 M CHG 1 24 -1 M END