PUBCHEM-ZINC06208826 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 0 0 0 0 0 0999 V2000 0.0400 1.0120 1.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 -0.1240 0.5140 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1180 -0.8480 0.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8050 -2.0180 -0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5570 -2.0740 -0.3910 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0890 -2.8230 -0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0800 -0.8780 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4210 -0.5530 0.0120 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.4720 -1.5880 -0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5280 -1.1710 -1.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9860 1.2350 -0.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8970 0.8480 0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2340 0.5760 -1.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0400 1.7480 -1.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9290 3.0020 -1.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6670 4.0910 -1.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5210 3.9390 -0.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6490 2.6980 0.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9120 1.6060 -0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7110 -2.9600 -0.6020 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0820 -2.7430 -0.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9290 -3.5770 -0.7400 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4300 -1.4910 0.1300 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5290 -0.4780 0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8470 0.6400 0.8720 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8520 -1.2430 0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2560 -4.2110 -1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7690 0.8350 2.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3000 1.9130 0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9200 1.1580 1.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0290 -2.5370 -0.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9450 -1.7510 0.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0970 -1.0950 -2.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3590 -1.8830 -1.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4270 2.1960 -0.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5740 1.2950 -1.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2760 0.9490 1.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0660 1.5420 0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8900 -0.2990 -1.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8010 0.7600 -2.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2760 3.1460 -2.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5840 5.0590 -1.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0980 4.7880 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3320 2.5820 1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0440 0.6450 0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2900 -2.0690 0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3330 -1.2110 -0.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0440 -0.3050 0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7160 -3.9920 -2.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0870 -4.8820 -1.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5880 -4.7170 -0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0880 0.1930 -0.8670 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.4980 0.1430 0.0760 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 2 7 1 0 0 0 0 3 4 2 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 10 52 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 11 52 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 13 52 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 27 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 26 1 0 0 0 0 24 25 2 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 8 1 M CHG 1 52 1 M END