PUBCHEM-ZINC02046956 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 49 0 0 1 0 0 0 0 0999 V2000 0.0230 1.8500 0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1840 0.4930 -0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8840 -0.3230 -0.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1640 0.2370 -0.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3730 1.5920 -0.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2980 2.4050 0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4800 3.8470 0.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7680 4.3930 1.1630 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4380 4.4740 -0.4270 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 5.8720 -0.2800 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0260 6.4610 0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0920 5.9920 0.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8060 5.6130 2.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9790 5.7810 3.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1020 6.0610 2.5620 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3170 6.4320 -1.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6630 5.5340 -2.4960 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7660 -1.6980 -0.7780 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3890 -2.4810 -0.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4990 -2.0730 -0.4240 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 -3.7870 -1.1360 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9500 -4.8640 -1.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4560 -6.0560 -1.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4530 -7.1730 -1.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1210 -8.3020 -2.0520 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7380 -6.8640 -1.3520 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1060 -5.6140 -0.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2610 -4.6400 -0.8940 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4150 -7.6080 -1.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4080 -5.4300 -0.6430 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 -6.3940 -1.9820 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8190 2.4700 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1930 0.1080 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0170 -0.3730 -0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3830 1.9890 -0.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9140 4.0120 -1.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9040 5.3600 0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4690 7.0230 0.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9710 6.2180 2.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5040 4.5620 2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6230 -2.1620 -1.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 -3.9770 -1.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1080 -6.1550 -0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6900 -4.5020 -0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6060 -5.7550 -1.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9790 -7.3640 -2.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6760 5.6040 4.2830 O 0 5 0 0 0 0 0 0 0 0 0 0 3.2580 7.6860 -1.8020 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 18 1 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 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 14 15 2 0 0 0 0 14 47 1 0 0 0 0 16 17 2 0 0 0 0 16 48 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 28 1 0 0 0 0 23 24 1 0 0 0 0 23 31 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 29 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 30 43 1 0 0 0 0 30 44 1 0 0 0 0 31 45 1 0 0 0 0 31 46 1 0 0 0 0 M CHG 1 47 -1 M CHG 1 48 -1 M END