PUBCHEM-ZINC06037919 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 0.9830 1.7550 0.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 0.3130 0.7350 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9230 -0.1980 -0.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8950 -0.4260 2.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 0.0550 3.1490 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2320 -0.1390 3.0660 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7790 0.6780 1.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0630 0.2770 0.5910 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3810 0.9390 -0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4670 -1.0420 0.2110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4500 -1.6010 1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8710 0.2000 4.4510 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0310 -1.1880 5.0860 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8630 -1.2160 5.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7660 -1.7110 5.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7920 -3.2230 5.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0000 -3.9830 4.6780 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1290 -5.0440 4.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2990 -3.5190 4.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4030 -2.0060 3.8530 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4310 -1.7740 3.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5530 -1.5290 2.8020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2080 -3.9910 3.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3050 -3.5860 4.1890 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0980 1.2160 5.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0730 2.4700 4.6130 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2990 2.4330 4.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2010 0.7410 4.2770 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0780 1.7690 0.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 2.2890 -0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6140 2.3160 1.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7500 -1.5080 1.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9630 -0.2740 2.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8510 0.4870 1.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6340 1.7490 2.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1330 -1.4500 5.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6620 -1.2210 6.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 -3.5390 6.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6040 -3.4730 6.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4230 -3.9960 3.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1390 -3.8560 4.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6200 1.3890 6.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0710 0.9190 5.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0790 1.7080 4.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -4.4530 2.5560 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 12 25 1 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 20 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 23 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 28 44 1 0 0 0 0 M CHG 1 45 -1 M END