PUBCHEM-ZINC04545842 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 40 0 0 1 0 0 0 0 0999 V2000 -0.5120 1.1500 1.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 -0.2840 0.6110 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3150 -0.8010 1.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6380 -1.0000 0.4260 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3060 -0.3880 -0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4500 -2.3590 -0.2440 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4320 -2.7790 -0.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5370 -2.2770 -1.4880 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0900 -1.6390 -2.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7670 -1.4740 -1.1680 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2790 -1.2720 -2.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4400 -0.1870 -0.6200 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6450 -2.1750 -0.2780 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0450 -2.0430 -0.5750 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2610 -1.1130 -1.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7440 -1.9910 0.8010 C 0 0 3 0 0 0 0 0 0 0 0 0 4.8200 -2.1810 0.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5420 -0.6560 1.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2130 -0.7150 2.7820 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0070 -1.6060 3.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1870 -3.0090 1.6580 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2400 -3.0570 1.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5300 -3.2650 -1.3810 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1500 -4.2040 -0.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1250 -3.2100 -2.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9690 -3.2220 -3.7430 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9670 -3.3110 -1.3880 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2330 -3.5280 -1.8330 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.8770 -3.2630 0.7200 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3930 -3.8620 0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2590 -1.2080 1.6990 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9140 -2.0830 1.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7510 1.8160 1.1700 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2050 1.5580 0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1390 1.7190 0.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 1.1770 2.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9540 0.1790 0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4900 -0.4620 1.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0530 -3.2140 -3.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2330 -3.5000 -2.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 12 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 31 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 29 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 28 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 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 14 23 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 21 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 27 1 0 0 0 0 25 26 2 0 0 0 0 25 39 1 0 0 0 0 27 40 1 0 0 0 0 29 30 1 0 0 0 0 31 32 1 0 0 0 0 33 34 1 0 0 0 0 M CHG 1 28 -1 M END