IFLAB-ZINC04033737 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 1 0 0 0 0 0999 V2000 0.1220 1.3770 -0.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1350 -0.0050 -0.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -0.6940 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2490 0.0020 0.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2330 1.3830 0.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0710 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 3.5780 0.0060 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2160 3.9440 -0.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 4.0720 1.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4340 4.6660 1.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2260 4.9670 3.1790 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0230 4.5850 3.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4230 4.0220 2.4450 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4730 3.6530 2.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6720 4.9280 1.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6330 4.0400 -0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2890 4.1030 -0.7760 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0990 4.6260 -2.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5130 4.8090 -2.6200 S 0 0 0 0 0 0 0 0 0 0 0 0 3.1580 5.0070 -2.7450 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9060 4.0490 -3.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9340 4.4470 -4.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6710 3.5000 -4.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3850 2.1550 -4.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3610 1.7550 -3.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6260 2.6980 -3.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3130 0.9670 -5.6730 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 -2.0450 -0.0760 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.7060 1.9150 -1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6840 -0.5460 -1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0800 -0.5350 0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0510 1.9260 0.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 4.7010 4.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6980 5.9760 0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5580 4.6900 1.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3680 4.3950 -0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8600 3.0100 0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4020 5.9440 -2.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1570 5.4970 -4.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4710 3.8100 -5.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1400 0.7050 -3.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8300 2.3850 -2.6200 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 17 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 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 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 26 42 1 0 0 0 0 M END