CHEMBRIDGE-ZINC05027800 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 0 0 0 0 0 0999 V2000 2.1330 1.4000 0.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1450 0.0190 0.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -0.6810 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2530 0.0000 -0.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2350 1.3810 -0.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 2.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 3.4850 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3180 4.1720 0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3770 3.5800 0.0910 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2950 5.6740 0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6680 6.1780 0.3120 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3400 6.5050 -0.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5580 6.9560 -0.7910 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2230 7.1230 0.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5970 6.8090 1.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2550 6.3190 1.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6560 6.0300 2.5380 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4450 7.0470 2.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6570 7.5180 2.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8490 7.7050 0.6920 S 0 0 0 0 0 0 0 0 0 0 0 0 8.7300 7.8480 3.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0780 7.9580 4.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2100 6.7190 5.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9840 6.7820 4.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -2.1610 0.0030 N 0 3 0 0 0 0 0 0 0 0 0 0 2.0620 -2.7610 0.6500 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3960 -2.7780 -0.6440 O 0 5 0 0 0 0 0 0 0 0 0 0 2.8640 1.9450 1.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8890 -0.5160 1.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4790 -0.5490 -1.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5100 1.9120 -1.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3190 3.9610 -0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 6.1010 -0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7460 5.9570 1.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8470 6.3880 -1.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4790 7.0560 3.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2020 8.7960 3.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8520 8.0160 5.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4560 8.8530 4.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7860 5.8220 4.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8890 6.6960 6.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3260 7.5870 4.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4500 5.8320 4.2000 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 2 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 2 0 0 0 0 18 19 2 0 0 0 0 18 24 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 M CHG 1 25 1 M CHG 1 27 -1 M END