IBS-ZINC01751162 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 30 0 0 1 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7530 1.5930 -1.2320 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2320 1.2820 -2.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1770 1.0800 -1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5360 -0.0780 -1.2720 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0380 2.2740 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0800 5.3620 -1.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2620 3.4120 -1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7590 4.6730 -1.1350 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8830 3.0980 -1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 3.8960 -1.1680 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5090 2.2550 -1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2370 1.9850 -2.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9530 2.0440 -1.9410 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.6720 2.4500 -0.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3030 2.5220 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8660 2.8310 1.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7750 3.0500 2.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1360 2.9710 2.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5830 2.6820 0.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 1.4370 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8200 1.7600 -3.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8080 2.8940 1.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4300 3.2860 3.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8460 3.1450 2.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6440 2.6220 0.5880 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 10 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 8 2 0 0 0 0 6 12 1 0 0 0 0 7 9 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 24 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 25 1 0 0 0 0 18 19 2 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 19 27 1 0 0 0 0 20 28 1 0 0 0 0 M END