IFLAB-ZINC01060694 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7050 1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0930 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7740 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0740 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6900 -1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 0.1860 -2.6970 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -0.0130 2.4190 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1530 0.3600 3.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2770 0.1520 2.6340 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 1.0810 4.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 1.0610 4.3360 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1080 0.5170 5.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0980 0.3350 3.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2240 0.1020 2.6740 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4000 2.7460 4.3150 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.1200 2.4040 4.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5640 1.0900 4.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9100 0.8250 4.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8310 1.8620 4.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4110 3.1690 4.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0490 3.4560 4.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5920 4.8520 4.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4080 5.0970 4.3080 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6410 2.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -3.8530 -0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.6080 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 0.5480 5.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 2.1060 4.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8540 0.2770 4.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2500 -0.1970 4.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8830 1.6420 4.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1330 3.9720 4.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4880 5.8590 4.4660 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1400 6.7590 4.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 9 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 17 1 0 0 0 0 15 16 2 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 22 2 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 38 1 0 0 0 0 38 39 1 0 0 0 0 M END