IBS-ZINC05452398 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 1 0 0 0 0 0999 V2000 0.1750 0.5420 0.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3280 -0.8130 0.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5830 -1.3770 0.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7100 -0.5820 0.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5490 0.7910 0.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2680 1.3420 0.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9010 1.3370 0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7560 0.3170 0.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0620 -0.8370 0.7910 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4640 -1.7060 0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2630 2.7720 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3010 3.5600 1.3990 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9800 3.0720 2.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7810 4.9630 1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0730 5.9060 1.3920 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9560 3.6080 1.9790 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8000 3.7800 3.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5350 3.9470 3.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 4.0880 2.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 4.0620 1.7620 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8540 4.2470 3.5630 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9820 4.2760 4.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0950 4.4220 5.3640 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 4.1540 5.7420 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3120 3.9840 5.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2400 3.8680 6.0720 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8160 0.9680 0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 -1.4320 1.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6920 -2.4320 1.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 2.3950 0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8320 0.3960 0.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2430 2.8110 -0.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5180 3.2080 -0.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1780 3.5170 1.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6640 3.7880 3.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6440 4.3420 3.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1140 4.1840 6.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9960 5.1640 0.5930 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2600 6.0810 0.4380 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 14 15 2 0 0 0 0 14 38 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 25 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 36 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 37 1 0 0 0 0 25 26 2 0 0 0 0 38 39 1 0 0 0 0 M END