IFLAB-ZINC00123826 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 29 0 0 1 0 0 0 0 0999 V2000 0.0230 1.1820 -0.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -0.0530 0.1490 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7700 -0.6260 0.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3300 -0.3910 0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0810 0.6820 -0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2400 1.6560 -0.5880 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4870 0.5920 0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9650 -0.5670 0.6150 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1080 -1.5260 1.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -1.5270 0.9420 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3710 1.5650 -0.3290 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9900 2.8360 -0.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2960 3.6250 -0.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3750 2.5500 -1.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8200 1.4150 -0.1730 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1590 0.4560 -0.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3660 1.5730 1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9270 2.5480 1.9460 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8910 1.6820 -0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5630 -2.4060 1.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5860 2.6820 -1.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2560 3.3800 -0.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3280 4.3000 -1.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4160 4.2330 -0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4810 2.2010 -2.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3480 2.9260 -0.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2490 0.7220 1.5930 O 0 5 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 19 1 0 0 0 0 2 3 1 0 0 0 0 2 4 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 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 20 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 21 1 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 13 23 1 0 0 0 0 13 24 1 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 14 26 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 27 1 0 0 0 0 M CHG 1 27 -1 M END