PUBCHEM-ZINC00038645 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 1 0 0 0 0 0999 V2000 -0.6800 1.6950 0.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7060 0.1890 0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4910 -0.6200 1.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 -2.0170 1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8370 -2.6300 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0150 -1.8580 -1.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9350 -0.4650 -1.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0640 0.2870 -2.2890 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.0910 0.1080 -2.9580 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1230 1.0320 -2.5930 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.1980 0.0020 2.5770 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0450 -0.5940 3.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1140 -1.7950 4.0740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 0.4550 4.9440 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6690 1.3090 4.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3080 0.9500 5.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2870 1.9450 6.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5860 1.3640 7.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 0.8940 7.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8330 -0.1070 6.1790 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3450 -1.0360 6.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3210 -0.4230 5.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8140 0.0780 4.8710 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3550 2.0520 0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1950 2.1800 -0.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2100 2.0400 1.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4120 -2.6710 2.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8870 -3.7140 -0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 -2.3430 -2.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 1.0070 2.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7810 1.4200 4.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9430 0.0950 5.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7750 2.8630 6.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3130 2.2270 6.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 2.1190 8.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1680 0.5210 8.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4440 1.7660 7.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 0.4440 8.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8750 -1.1410 6.8010 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 M CHG 1 8 1 M CHG 1 10 -1 M CHG 1 39 -1 M END