CHEMBRIDGE-ZINC02870852 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1240 -0.9400 -1.4230 N 0 3 0 0 0 0 0 0 0 0 0 0 5.1970 -0.4740 -1.8370 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5960 -0.6990 -3.1760 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8510 -0.1060 -3.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1590 -0.3910 -4.8820 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3890 0.1550 -5.3220 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7650 -0.0250 -6.4890 N 0 3 0 0 0 0 0 0 0 0 0 0 10.0380 0.5400 -6.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9470 -0.5720 -7.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9250 -0.9860 -8.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7580 -2.0070 -9.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6140 -2.6130 -8.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6370 -2.1980 -6.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8070 -1.1750 -6.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9640 -0.7760 -7.3830 O 0 5 0 0 0 0 0 0 0 0 0 0 3.2990 -1.6960 -2.2900 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 -0.1100 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5990 -1.6640 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7930 0.9740 -3.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6320 -0.5150 -2.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8570 1.2240 -7.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5100 1.0810 -6.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2560 -0.5130 -9.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7410 -2.3310 -10.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2650 -3.4110 -8.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3060 -2.6720 -6.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8270 -0.8480 -5.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 15 34 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 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 M CHG 1 8 1 M CHG 1 14 1 M CHG 1 22 -1 M CHG 1 23 -1 M END