IBS-ZINC05389378 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 58 0 0 0 0 0 0 0 0999 V2000 1.2160 1.4420 -0.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0110 0.0300 -0.5040 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4310 -0.5840 0.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 -1.9540 0.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6870 -2.5800 1.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2880 -1.8360 2.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4570 -0.4600 2.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0340 0.1590 1.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7460 -2.5060 4.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3480 -1.7320 5.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7810 -2.3480 6.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5790 -3.7930 6.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9830 -4.5020 7.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7760 -5.8480 7.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1690 -6.5270 6.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7650 -5.8680 5.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9600 -4.4780 5.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5700 -3.8050 4.3130 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4210 -1.5740 7.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9930 -1.6520 8.5820 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4780 -0.7830 7.1780 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1780 -0.0760 8.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6710 -0.4140 8.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1910 -0.0970 6.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4470 -0.9430 5.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9560 -0.6150 5.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5940 -0.3790 6.7130 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2650 0.8580 6.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2400 1.9340 6.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9840 1.2970 6.4970 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2810 1.6590 -0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8360 1.8050 -1.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 1.9380 0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 -2.5300 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5550 -3.6460 2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9220 0.1190 3.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1690 1.2240 1.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4740 -0.6680 5.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4550 -3.9860 8.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0880 -6.3950 8.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0170 -7.5930 6.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2960 -6.4100 4.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0400 0.9990 8.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7800 -0.3950 9.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2160 0.1810 8.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8150 -1.4730 8.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8330 -0.7230 4.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5920 -2.0000 5.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4110 -1.2900 5.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8000 0.4160 5.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1890 0.9520 6.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4650 0.9270 5.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3060 2.1240 7.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3750 2.8540 6.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 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 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 0 0 0 0 10 11 2 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 19 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 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 27 1 0 0 0 0 24 30 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 M END