IFLAB-ZINC04059812 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 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 4.2230 -0.9950 -1.7530 S 0 0 0 0 0 0 0 0 0 0 0 0 5.7530 -1.8500 -1.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3520 -2.1850 -0.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5310 -2.8450 -0.6740 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7180 -2.9500 -2.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6130 -2.3390 -2.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5310 -2.3020 -4.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5230 -2.8630 -4.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6140 -3.4700 -4.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7190 -3.5100 -2.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4510 -3.3580 0.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5480 -2.3250 0.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4680 -2.8390 1.6250 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5200 -2.0950 2.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7060 -0.9970 1.5310 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4480 -2.6130 3.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5390 -1.8440 3.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4010 -2.3330 4.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1870 -3.5840 4.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1070 -4.3510 4.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2340 -3.8700 3.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2780 -4.1930 6.1770 Cl 0 0 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 5.9650 -1.9680 0.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6860 -1.8330 -4.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4590 -2.8350 -5.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3900 -3.9090 -4.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5700 -3.9860 -2.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9020 -3.5490 1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9020 -4.2860 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0970 -2.1350 -0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0970 -1.3980 0.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3200 -3.7150 2.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7070 -0.8690 3.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2450 -1.7390 4.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9460 -5.3260 5.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3900 -4.4670 3.3040 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 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 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 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 37 1 0 0 0 0 11 12 1 0 0 0 0 11 18 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 M END