PUBCHEM-ZINC04962085 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 -1.8870 1.8830 -0.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5030 0.4110 -0.3890 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0220 0.0990 -1.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5010 0.2180 0.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1590 -1.2560 0.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 -2.1050 1.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7500 -0.4480 -0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5720 -2.7980 0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2730 -4.2510 -0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3170 -5.1870 0.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0360 -6.5520 0.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6970 -7.0190 -0.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6510 -6.0940 -1.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9260 -4.7440 -1.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8050 -4.0010 -2.5400 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4710 -4.9060 -3.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3280 -4.4760 -4.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0640 -5.2920 -5.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4220 -4.9380 -7.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4250 -6.0660 -7.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0810 -7.0520 -7.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4790 -6.5960 -6.0850 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3220 -6.2630 -2.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9640 -7.3100 -3.5040 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6280 -4.7380 2.1570 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0010 2.5000 -0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5760 2.0280 -1.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3760 2.2540 0.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4170 0.7810 0.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9180 0.6150 1.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3940 -1.6170 0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5050 -1.3710 1.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1320 -3.1630 1.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9410 -1.8350 2.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3020 -0.1590 0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4150 -0.3850 -1.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2660 -2.4690 -0.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0580 -2.5930 1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0730 -7.2610 1.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4740 -8.0660 -0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4330 -3.4110 -5.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9950 -3.9690 -7.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0060 -6.1460 -8.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3380 -8.0780 -7.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6820 -5.4980 2.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3500 -1.8970 -0.0180 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.8520 -2.1670 -0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 7 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 6 46 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 7 46 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 8 46 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 23 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 23 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 23 24 2 0 0 0 0 25 45 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 46 1 M END