IFLAB-ZINC04749985 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 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 5.4070 -1.6570 -1.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7980 -1.8770 -2.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0810 -1.4770 -3.8120 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9460 -2.5190 -3.2150 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3070 -2.7230 -4.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6150 -2.3360 -5.5670 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1080 -2.6130 -6.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2730 -3.2650 -6.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7330 -3.5130 -5.0580 S 0 0 0 0 0 0 0 0 0 0 0 0 9.0600 -3.7060 -7.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0160 -2.6140 -8.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3470 -2.6910 -7.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2240 -1.6890 -8.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7710 -0.6080 -9.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4400 -0.5300 -9.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5630 -1.5360 -9.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8930 -1.4410 -9.5540 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 5.3060 -2.6200 -0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1750 -1.0660 -0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5200 -2.8400 -2.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6100 -2.3340 -7.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6200 -4.6090 -7.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3760 -3.9130 -8.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7020 -3.5350 -7.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2640 -1.7500 -8.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4570 0.1750 -9.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0860 0.3140 -10.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1260 -0.9400 -1.4270 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4120 -1.4360 -1.9380 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 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 28 1 0 0 0 0 6 29 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 7 42 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 8 42 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 34 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 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 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 42 43 1 0 0 0 0 M END