IBS-ZINC05151294 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 40 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.3780 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -0.0080 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 -0.6940 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 0.0040 -0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 1.4060 -0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 2.0870 -0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7890 1.8280 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5360 0.6450 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6880 -0.4040 -0.0800 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9320 0.7540 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4790 1.9660 -0.0900 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7330 3.0540 -0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4180 3.0000 -0.0830 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9450 -0.6880 -0.0910 S 0 0 0 0 0 0 0 0 0 0 0 0 8.5850 0.0800 -0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6420 -0.9940 -0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3190 -2.1630 -0.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9460 -0.6550 -0.1040 N 0 0 0 0 0 0 0 0 0 0 0 0 11.9280 -1.6490 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7230 -2.8870 -0.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6930 -3.8650 -0.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8690 -3.6140 0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0770 -2.3820 0.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1120 -1.3970 0.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3770 0.1510 1.4090 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 1.9040 -0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -0.5560 -0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -1.7740 -0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 3.1670 -0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2170 4.0200 -0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6930 0.6990 -0.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6990 0.7000 0.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2050 0.2770 -0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8050 -3.0840 -1.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5340 -4.8280 -0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6260 -4.3810 0.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9970 -2.1890 1.2950 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 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 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 13 2 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 34 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 22 23 2 0 0 0 0 22 36 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 24 25 1 0 0 0 0 M END