IFLAB-ZINC05155415 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 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 0.6730 -0.5820 1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6330 -2.1080 1.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3210 -2.7010 2.1600 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6380 -3.0930 2.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9490 -3.5960 3.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7360 -3.5180 4.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 -2.9420 3.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 -2.7340 3.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8060 -3.0890 5.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1740 -3.6530 6.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4310 -3.8740 5.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2010 -4.1000 3.7850 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2330 -4.1080 2.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0820 -3.6800 1.7900 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4310 -4.5910 3.3020 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5530 -4.6000 2.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7870 -5.1950 3.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9580 -5.2040 2.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1400 -5.7740 2.7100 N 0 0 0 0 0 0 0 0 0 0 0 0 11.4990 -7.0940 2.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6440 -7.1760 3.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9740 -5.9390 3.8350 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0810 -5.0930 3.4000 C 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 1.7100 -0.2470 1.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 -0.2720 2.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4040 -2.4430 0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 -2.4180 0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3200 -3.0110 1.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2980 -2.2950 3.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7960 -2.9260 5.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0590 -3.9250 7.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1890 -4.3120 6.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3210 -4.4410 4.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5510 -4.9330 4.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2920 -5.2040 1.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7690 -3.5800 2.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0480 -4.5920 3.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5700 -6.2150 3.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6970 -5.8080 1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1750 -4.1840 1.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9680 -7.9140 2.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1980 -8.0790 3.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0910 -4.0260 3.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 14 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 22 23 2 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 25 48 1 0 0 0 0 M END