PUBCHEM-ZINC03620175 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 0 0 0 0 0 0999 V2000 -0.1620 1.1840 -0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1780 0.8620 2.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6200 3.1550 1.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5430 3.6640 2.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5470 5.1930 2.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4490 5.5280 3.6300 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6780 6.8500 3.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6370 7.3760 4.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5810 6.8310 5.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3460 7.6920 6.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1680 9.0680 6.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2400 9.6260 5.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5020 8.7590 4.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5340 8.9610 3.5880 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9550 7.7840 3.1960 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1190 10.1840 2.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9700 11.2940 2.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5430 12.4830 2.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2670 12.5740 1.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4020 11.4730 1.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8450 10.2690 2.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 11.5750 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4360 12.8550 1.1230 F 0 0 0 0 0 0 0 0 0 0 0 0 1.9160 10.8820 1.8940 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0110 11.0900 -0.0730 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 0.1090 -0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9090 1.4060 -0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6720 1.7140 -0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8790 1.1200 2.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2990 -0.2020 2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7390 1.1070 3.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 3.6030 0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4330 3.3770 1.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5690 3.3150 2.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2490 3.2570 3.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 5.5540 2.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8890 5.6220 1.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7020 5.7550 5.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0720 7.2820 7.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7530 9.7210 6.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0970 10.7010 5.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9930 11.2580 3.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2130 13.3390 2.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 13.5110 1.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1730 9.4120 2.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7510 1.6480 1.2150 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.7560 1.4310 1.1720 H 0 0 0 0 0 0 0 0 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 1 46 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 2 46 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 46 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 15 2 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 46 1 M END