IBS-ZINC01889465 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 32 0 0 1 0 0 0 0 0999 V2000 0.0280 0.7090 -0.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3630 -0.4880 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9550 -0.3850 0.5600 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0530 1.2260 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 1.6900 -0.6290 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2500 1.8350 0.2690 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5180 3.1420 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7580 3.9140 -0.6680 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9360 3.5320 0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2150 5.0190 0.0950 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7370 5.4260 -0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7010 5.2620 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3820 4.7000 -0.8940 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1660 6.1690 0.8870 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2720 6.6930 1.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4880 7.5150 2.6620 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6850 5.9970 1.5300 S 0 0 0 0 0 0 0 0 0 0 0 0 8.5700 6.5620 0.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8220 7.7290 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2920 8.1290 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0700 7.4790 0.6810 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9170 0.9220 -1.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2290 -1.3870 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9370 1.2740 0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1480 3.2090 1.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5910 2.9380 -0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8450 6.8330 1.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1760 5.6970 0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5080 7.4710 -1.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2300 8.5990 0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5490 9.0790 -0.8620 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 3 4 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 24 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 25 1 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 18 19 1 0 0 0 0 18 27 1 0 0 0 0 18 28 1 0 0 0 0 19 20 1 0 0 0 0 19 29 1 0 0 0 0 19 30 1 0 0 0 0 20 21 2 0 0 0 0 20 31 1 0 0 0 0 M CHG 1 31 -1 M END