IFLAB-ZINC02694435 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 46 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7350 -0.0630 1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 -0.1240 2.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8700 -2.0110 1.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2630 -2.8000 1.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 -4.1760 1.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1040 -4.7660 1.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2400 -3.9820 1.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1250 -2.6010 1.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2420 -1.8270 1.2110 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5010 -2.5020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6320 -1.4740 1.2580 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4930 -0.8340 2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9750 -2.2000 1.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3570 -1.8760 1.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5940 -2.3040 3.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4570 -0.9050 1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6160 -0.6750 0.0730 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4860 -0.4850 3.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1340 0.9610 2.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0340 -0.5720 2.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2410 -2.3400 1.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0330 -4.7900 1.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 -5.8410 0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2160 -4.4440 1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5660 -3.1680 2.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5890 -3.0840 0.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9540 -2.8760 2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1540 -2.7700 0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3740 -2.7550 1.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8100 -2.9960 3.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5630 -2.7950 3.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5760 -1.4260 3.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4270 -1.3960 1.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2890 -0.6010 0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4400 -0.0270 1.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7350 -1.1800 -0.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0500 -1.2150 1.5470 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0490 -0.5370 0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 26 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 2 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 37 1 0 0 0 0 17 45 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 44 1 0 0 0 0 45 46 1 0 0 0 0 M END