IBS-ZINC05531241 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 46 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -0.6180 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 0.1470 2.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8380 -0.4560 3.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9000 -1.8470 3.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3160 -2.6280 2.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6730 -1.9990 1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5290 -3.9510 2.4800 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 -4.7060 1.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2230 -4.0440 3.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4840 -2.7980 4.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2100 -2.4640 5.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3880 -1.2220 5.7000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0780 -0.9040 6.8770 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2670 0.4200 7.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9230 0.7060 8.3490 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1040 1.9790 8.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5870 2.9780 7.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9340 4.2690 8.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7050 5.5960 8.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1680 6.6110 8.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8610 6.3140 10.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0940 5.0040 10.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6340 3.9660 9.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7230 2.5890 9.7520 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1610 2.1210 10.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9410 2.6270 6.7370 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7930 1.3800 6.4450 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 1.2250 1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2880 0.1440 3.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 -2.5870 0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5180 -4.9670 4.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5950 -3.2530 5.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4240 -1.6120 7.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1660 5.8300 7.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9910 7.6410 8.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2210 7.1150 10.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6350 4.7840 11.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 29 2 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 19 28 2 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 28 29 1 0 0 0 0 M END