IBS-ZINC03171831 MOE2007 3D CORINA 3.40 0006 02.08.2006 25 25 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3800 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 -0.6510 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 0.1220 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3360 1.4370 -0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1800 2.0730 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 -2.1270 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3030 -2.7900 -0.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5240 -2.7380 -0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6020 -4.2010 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0690 -4.6330 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1650 -6.4440 -0.0710 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7140 -6.9750 1.1680 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6900 -6.9620 -1.3060 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9560 1.9130 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9170 -0.5700 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3710 -0.3630 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 3.1530 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3370 -2.2090 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1160 -4.5950 0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0990 -4.5860 -0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5540 -4.2380 -0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5710 -4.2470 0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6570 -6.7450 -0.0870 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8680 -7.6890 -0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 15 1 0 0 0 0 2 3 2 0 0 0 0 2 16 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 17 1 0 0 0 0 5 6 1 0 0 0 0 6 18 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 19 1 0 0 0 0 10 11 1 0 0 0 0 10 20 1 0 0 0 0 10 21 1 0 0 0 0 11 12 1 0 0 0 0 11 22 1 0 0 0 0 11 23 1 0 0 0 0 12 13 2 0 0 0 0 12 14 2 0 0 0 0 12 24 1 0 0 0 0 24 25 1 0 0 0 0 M END