IFLAB-ZINC03865745 MOE2007 3D CORINA 3.40 0006 02.08.2006 23 23 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5380 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 -0.8510 -0.3660 -0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2810 -0.5620 -0.6100 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7870 -1.1810 0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2430 0.5520 -1.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7680 1.9710 -0.0040 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3150 1.8010 1.2960 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9620 3.1900 -0.7090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8500 -1.5910 -2.0400 S 0 0 0 0 0 0 0 0 0 0 0 0 0.1770 -2.7700 -1.6200 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3340 -0.7900 -3.0940 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1400 -0.6040 1.7080 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 -2.0170 1.7290 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8040 0.0490 2.5460 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 1.9220 -0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4990 1.9120 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2790 0.2660 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0820 0.7900 -2.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1870 -2.0900 -2.5670 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4880 -0.0820 2.1830 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7060 -0.3260 3.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1160 -2.6620 -3.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 7 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 13 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 6 7 1 0 0 0 0 6 18 1 0 0 0 0 6 19 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 20 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 M END