IBS-ZINC02242550 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 33 0 0 0 0 0 0 0 0999 V2000 -0.3620 1.3470 1.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1610 -0.0550 1.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 -0.7210 1.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 -2.0840 0.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2580 -2.6680 1.1290 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2180 -2.6990 0.2680 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 -2.0880 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8340 -2.6700 -0.5720 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1920 -0.7200 0.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3520 -0.1180 0.3110 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4030 1.1680 0.2200 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6080 1.8300 0.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7740 1.1080 0.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9700 1.7680 0.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0190 3.1520 0.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8730 3.8860 0.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6540 3.2340 0.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4230 4.0130 0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3880 3.4440 -0.1130 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0980 -0.0800 2.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9410 0.4280 2.7310 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3090 1.5260 2.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1470 2.0600 0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3950 1.4690 2.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 -3.6020 -0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6010 1.6720 0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7450 0.0280 0.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8740 1.2020 1.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9600 3.6590 0.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9160 4.9660 0.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4450 5.3560 0.2830 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6140 5.8230 0.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 9 1 0 0 0 0 3 4 1 0 0 0 0 3 20 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 25 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 15 16 2 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 31 1 0 0 0 0 20 21 3 0 0 0 0 31 32 1 0 0 0 0 M END