IBS-ZINC00531470 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3890 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 1.1780 -0.6910 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3920 0.0120 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3710 1.4310 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 2.1060 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6000 2.1180 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7120 1.4140 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6950 0.0820 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5740 -0.6140 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2290 -0.7840 -0.0600 S 0 0 0 0 0 0 0 0 0 0 0 0 7.3790 0.6140 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7950 0.1000 -0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0070 -1.0940 -0.0870 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8270 0.9670 -0.0840 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2040 0.4670 -0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1360 1.5180 0.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5740 0.9960 0.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9960 0.7110 -0.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0650 -0.3410 -1.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6270 0.1820 -1.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9640 1.9080 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9310 -0.5480 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 -1.7710 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 3.1850 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6290 3.1980 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2050 1.2260 -0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2210 1.2170 0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6580 1.9220 -0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2640 -0.4520 0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0760 2.4370 -0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8340 1.7210 1.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2370 1.7450 0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6330 0.0780 1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9370 1.6290 -1.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0210 0.3390 -0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3660 -0.5440 -2.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1250 -1.2590 -0.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9640 -0.5670 -1.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5680 1.1000 -2.1270 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 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 10 2 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 M END