IBS-ZINC05123735 MOE2007 3D CORINA 3.40 0006 02.08.2006 26 27 0 0 0 0 0 0 0 0999 V2000 -0.1600 1.4590 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 -0.0040 0.0080 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0650 -0.7880 1.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1050 -0.4220 2.2650 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.1750 0.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -3.3080 1.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 -4.6210 0.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4860 -5.7590 1.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3910 -6.9870 0.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2230 -7.1000 -0.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7480 -5.9770 -1.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6640 -4.7380 -0.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3490 -6.0950 -2.3680 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -2.0710 -0.7790 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 -0.7660 -1.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 -0.1560 -2.6950 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8480 1.8740 0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6760 1.8020 -0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 1.7880 0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1680 -3.2480 2.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9670 -5.6750 2.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7970 -7.8650 1.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2950 -8.0650 -1.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0760 -3.8660 -1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2990 -6.2700 -2.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -2.8100 -1.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 15 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 14 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 21 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 10 11 2 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 24 1 0 0 0 0 13 25 1 0 0 0 0 14 15 1 0 0 0 0 14 26 1 0 0 0 0 15 16 2 0 0 0 0 M END