PUBCHEM-ZINC05801157 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 0.7960 1.4740 -0.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7920 0.0450 -0.4840 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3940 -0.5650 -0.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5300 0.1980 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7350 -0.4210 0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8100 -1.8060 0.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6750 -2.5680 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 -1.9490 -0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7560 -4.0730 0.1310 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.7770 -4.3790 0.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8060 -4.6110 1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0740 -6.1050 1.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0500 -6.8080 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8940 -8.1960 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 -8.8910 -1.0680 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9880 -8.2960 -2.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1470 -6.8910 -2.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1740 -6.1420 -1.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3310 -4.6500 -1.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2740 -6.2810 -3.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2380 -7.0570 -4.6640 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0880 -8.3740 -4.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 -8.9920 -3.4000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0590 -9.1290 -5.7170 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4310 -4.9170 -3.7080 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9960 -2.4160 0.5860 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1240 -1.5690 0.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8020 1.8300 -0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1070 1.8260 -1.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 1.8540 0.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4720 1.2760 -0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6180 0.1720 0.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4120 -2.5430 -0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2270 -4.4580 0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9860 -4.0930 2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3080 -6.5340 2.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0520 -6.2430 1.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7930 -8.7140 0.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0870 -4.4100 -1.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3800 -4.2060 -1.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1480 -8.6970 -6.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9500 -10.0920 -5.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8920 -4.3180 -3.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0800 -4.5560 -4.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0030 -2.1810 1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9260 -0.9250 1.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3010 -0.9540 -0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 19 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 23 2 0 0 0 0 17 18 1 0 0 0 0 17 20 2 0 0 0 0 18 19 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 M END