IBS-ZINC04888680 MOE2007 3D CORINA 3.40 0006 02.08.2006 24 24 0 0 1 0 0 0 0 0999 V2000 -0.0340 1.5020 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.0040 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -0.6870 1.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 -2.1030 1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 -2.7400 2.1570 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.7370 -0.0590 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -3.7070 -0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0870 -2.0310 -1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2220 -2.8570 -2.6910 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 -0.6860 -1.1780 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2130 -0.1960 -2.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 0.0470 2.4710 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1210 1.1170 2.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8450 -0.4430 3.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5980 -0.2160 3.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3880 -0.9260 2.4980 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 1.8860 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 1.8610 -0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 1.8500 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7240 -1.5130 3.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 0.0880 4.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8260 -0.2530 2.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9290 0.3400 4.2500 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8100 0.1430 4.5970 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 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 12 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 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 14 20 1 0 0 0 0 14 21 1 0 0 0 0 14 22 1 0 0 0 0 15 16 2 0 0 0 0 15 23 1 0 0 0 0 23 24 1 0 0 0 0 M END