CHEMBRIDGE-ZINC04561786 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.3980 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -0.0050 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3150 -0.3790 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 0.7400 -0.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2680 1.8140 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8180 -1.7560 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0370 -2.6890 -0.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1460 -1.9880 -0.0430 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6080 -3.2540 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5160 -4.5650 0.0880 S 0 0 0 0 0 0 0 0 0 0 0 0 4.9310 -3.4870 -0.1660 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4470 -4.8590 -0.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5540 -5.0580 0.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5610 -3.9990 0.5990 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9850 -2.6740 0.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8950 -2.3770 -0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6670 -4.2380 1.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5070 -4.3210 2.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6020 -4.5570 3.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8570 -4.7110 3.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0210 -4.6300 1.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9280 -4.3990 0.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1330 -4.3040 -0.8630 Cl 0 0 0 0 0 0 0 0 0 0 0 0 12.0280 -4.9640 3.9130 N 0 3 0 0 0 0 0 0 0 0 0 0 11.8860 -5.0360 5.1210 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1340 -5.1000 3.4210 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.8960 2.0270 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 -0.6620 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5960 2.8430 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7680 -1.2440 -0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6420 -5.5710 -0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8540 -5.0080 -1.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1250 -5.0110 1.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0240 -6.0300 0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5500 -2.6600 1.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7670 -1.9170 0.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3440 -2.2920 -1.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3860 -1.4470 0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5280 -4.2000 3.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4790 -4.6210 4.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0020 -4.7500 1.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 29 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 M CHG 1 24 1 M CHG 1 26 -1 M END