IFLAB-ZINC04854130 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 1 0 0 0 0 0999 V2000 -1.0890 1.0720 1.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8600 -0.3730 1.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5520 -1.3680 1.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3410 -2.6940 1.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4380 -3.0260 0.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2540 -2.0310 -0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -0.7040 0.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2080 -4.4710 0.2320 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5710 -5.1150 1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -4.7170 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2880 -4.3710 0.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4740 -4.8140 0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1240 -5.4110 -0.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7700 -5.3520 -1.1010 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9580 -5.8660 -2.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4950 -6.0130 -1.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9030 -4.7960 -1.0280 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1040 -3.8180 -1.6150 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.9660 -2.5700 -0.9500 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0760 -3.9530 -3.0290 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6380 -4.5000 -1.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2450 -4.0220 0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4490 -4.5560 0.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0470 -5.5690 -0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4400 -6.0470 -1.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2380 -5.5080 -1.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1900 -7.3190 -2.3010 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.3950 1.3670 2.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 1.6950 0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1130 1.2010 1.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2570 -1.1100 2.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8820 -3.4720 2.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 -2.2890 -0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5770 0.0730 -0.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2170 -3.8510 1.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4780 -4.6950 0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8020 -5.8580 -1.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 -5.1700 -3.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3410 -6.8380 -2.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1400 -6.1560 -2.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5800 -6.8730 -1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7780 -3.2320 0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9220 -4.1830 1.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9870 -5.9860 0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7660 -5.8780 -2.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 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 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 17 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 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 16 41 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 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 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 45 1 0 0 0 0 M END