PUBCHEM-ZINC01366873 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 0 0 0 0 0 0999 V2000 -0.0060 1.6580 -0.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 0.1280 -0.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2890 -0.3870 -0.3740 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4260 -1.7400 -0.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2970 -2.5520 -0.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4170 -3.9240 -0.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6740 -4.5100 -0.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8180 -3.6930 -0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6830 -2.3010 -0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1360 -4.3230 -0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2070 -5.6770 -0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0300 -6.4520 -0.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1160 -7.6680 -0.1650 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8150 -5.8830 -0.2770 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0270 -6.4450 -0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5480 -6.3570 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0250 -6.7000 -1.3500 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6860 -7.9980 -1.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6900 -9.0500 -1.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9880 -8.7330 -1.9700 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7760 -5.8210 -2.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2360 -6.1340 -3.1240 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0400 -4.4780 -1.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6730 -4.3400 -0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9160 -3.0840 0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5350 -1.9560 -0.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9080 -2.0780 -1.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6500 -3.3350 -2.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0300 -3.4560 -3.4000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6620 -2.2460 -4.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0080 2.0510 -0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5920 1.9960 -1.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4660 2.0150 0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5000 -0.2290 -1.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -0.2100 0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -2.1020 -0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 -4.5440 -0.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5570 -1.6690 -0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0320 -3.7230 -0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4500 -7.2660 0.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2610 -5.6850 0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7230 -7.9240 -3.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6830 -8.2860 -1.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3880 -10.0320 -1.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7180 -9.0610 -0.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6770 -9.3600 -1.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9720 -5.2170 0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4060 -2.9780 1.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7300 -0.9750 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6140 -1.1940 -2.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1760 -2.4860 -5.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5550 -1.6520 -4.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9760 -1.6800 -3.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 2 0 0 0 0 7 14 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 M END