CHEMBRIDGE-ZINC04546985 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 0 0 0 0 0 0999 V2000 -0.0040 1.6790 -0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 0.1730 -0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6750 -0.4660 0.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 -1.8460 0.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -2.5910 -0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6050 -1.9460 -1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6260 -0.5660 -1.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2890 -2.7370 -2.1570 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.7840 -2.1760 -3.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3570 -3.9490 -2.0590 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0740 -3.9890 -0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2360 -4.6130 1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 -3.9680 2.1960 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3830 -6.1120 1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5410 -6.5320 2.5740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 -7.8660 2.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8450 -8.3420 4.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9930 -9.6970 4.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9840 -10.5820 3.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 -10.1050 1.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 -8.7510 1.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1310 -11.9150 3.4620 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1120 -12.7680 2.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 2.0310 -0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9220 2.0100 -0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 2.0840 0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 0.1140 1.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -2.3440 1.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1430 -0.0640 -1.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -4.5090 -0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5070 -6.5780 0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2580 -6.4100 0.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -7.6540 4.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 -10.0680 5.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8190 -10.7940 1.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5450 -8.3800 0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2390 -13.8040 2.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1590 -12.6600 1.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9240 -12.4910 1.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 M CHG 1 8 1 M CHG 1 10 -1 M END