OTAVA-ZINC05375576 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 28 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4980 -0.3750 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -0.5340 1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8400 -0.2970 1.5120 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 -1.2780 2.0110 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3970 -1.5130 1.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2670 -2.2300 2.3280 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5420 -2.3810 1.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2430 -1.2770 1.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5270 -1.4350 0.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1220 -2.6860 0.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4320 -3.7850 1.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1450 -3.6400 1.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0860 -5.1420 1.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2010 -6.0860 1.9080 F 0 0 0 0 0 0 0 0 0 0 0 0 -7.2470 -5.0990 2.1570 F 0 0 0 0 0 0 0 0 0 0 0 0 -6.4190 -5.5020 0.0660 F 0 0 0 0 0 0 0 0 0 0 0 0 -7.7380 -2.8770 0.2870 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.6920 -0.6700 0.1210 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2580 -1.6600 2.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7810 -0.3010 1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0710 -0.5820 0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6060 -4.4990 2.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 20 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 7 8 2 0 0 0 0 7 20 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 12 13 2 0 0 0 0 12 19 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 M END