IFLAB-ZINC05258071 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 44 0 0 1 0 0 0 0 0999 V2000 0.0000 1.5210 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -0.0090 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5400 -0.3620 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 -0.5130 1.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5780 -2.4950 2.3650 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3100 -1.8980 3.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 -3.9510 2.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2970 -4.0120 2.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9510 -2.9910 2.9950 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8820 -5.2000 3.1920 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2100 -5.2480 3.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7690 -4.1710 4.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0910 -4.2080 4.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8680 -5.3070 4.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3360 -6.4280 3.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9930 -6.3990 3.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4640 -7.5160 2.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2490 -8.6100 2.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5720 -8.6370 2.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1140 -7.5750 3.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0660 -2.4210 2.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5010 -1.9800 1.1050 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3180 -0.5050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0220 1.8990 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5210 1.8800 -0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 1.8730 0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7450 -0.0640 1.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1870 -0.2360 2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3540 -4.5310 1.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7520 -4.3640 3.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3810 -6.0220 3.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1740 -3.2870 4.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5080 -3.3520 5.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8920 -5.3180 4.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4410 -7.5090 2.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8400 -9.4680 2.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1730 -9.5160 2.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1400 -7.6110 3.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8390 -0.2300 0.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8790 -1.9750 1.1820 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 -2.4120 1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9090 -2.8450 3.0970 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8560 -2.7780 2.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 23 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 21 1 0 0 0 0 5 40 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 23 39 1 0 0 0 0 40 41 1 0 0 0 0 42 43 1 0 0 0 0 M END