PUBCHEM-ZINC05247716 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 68 0 0 1 0 0 0 0 0999 V2000 4.2700 -5.7880 -0.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9820 -4.6240 -1.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 -3.3000 -1.1850 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4720 -3.2630 -0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1930 -2.1370 -1.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9360 -3.1920 -1.6070 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3860 -4.0580 -1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8480 -3.1480 -3.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8760 -2.0820 -3.6890 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7370 -4.2920 -3.8140 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7490 -4.2570 -5.2780 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4680 -3.2600 -5.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1520 -4.5940 -5.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1560 -4.5920 -7.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1450 -3.5500 -5.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -5.2660 -5.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6450 -6.3430 -5.2680 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0190 -4.9720 -6.8960 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1320 -3.7510 -7.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -3.8400 -8.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 -4.8400 -8.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 -5.8220 -7.4670 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3880 -6.5550 -8.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8060 -6.5140 -6.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8430 -6.0290 -5.2570 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4500 -7.6710 -6.6200 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3560 -1.9690 -1.0480 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9090 -1.9560 0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9030 -2.9810 0.8770 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4690 -0.8070 0.7710 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 -0.8670 2.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1400 -1.3440 3.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5460 0.5240 2.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1710 -1.8440 2.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4800 -5.7570 0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1960 -5.7060 -1.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6290 -6.7310 -1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0470 -4.6640 -1.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8350 -4.6990 -2.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0370 -2.1100 -2.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8520 -1.2000 -1.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2540 -2.2710 -1.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6500 -5.1400 -3.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4420 -5.5800 -5.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9430 -3.5860 -7.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1340 -4.9090 -7.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3920 -5.2780 -7.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1020 -3.5120 -4.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1530 -3.8200 -5.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8870 -2.5720 -5.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9490 -2.8740 -7.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1260 -3.6920 -8.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3960 -2.8670 -8.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4990 -4.2290 -9.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6550 -4.3380 -7.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5070 -5.3550 -9.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4200 -8.0580 -7.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9430 -8.1160 -5.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2930 -1.1690 -1.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9760 -0.6480 2.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7900 -1.3890 4.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4650 -2.3350 2.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2650 0.8640 1.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1960 0.4790 3.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3820 1.2200 2.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1540 -2.8350 1.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5210 -1.8890 3.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9820 -1.5040 1.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 38 1 0 0 0 0 2 39 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 40 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 27 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 43 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 44 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 15 50 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 51 1 0 0 0 0 19 52 1 0 0 0 0 20 21 1 0 0 0 0 20 53 1 0 0 0 0 20 54 1 0 0 0 0 21 22 1 0 0 0 0 21 55 1 0 0 0 0 21 56 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 57 1 0 0 0 0 26 58 1 0 0 0 0 27 28 1 0 0 0 0 27 59 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 34 1 0 0 0 0 32 60 1 0 0 0 0 32 61 1 0 0 0 0 32 62 1 0 0 0 0 33 63 1 0 0 0 0 33 64 1 0 0 0 0 33 65 1 0 0 0 0 34 66 1 0 0 0 0 34 67 1 0 0 0 0 34 68 1 0 0 0 0 M END