PUBCHEM-ZINC05352275 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 39 0 0 1 0 0 0 0 0999 V2000 -0.4730 1.2780 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -0.1820 0.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 -0.3400 1.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 -1.0860 0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 -0.6210 -1.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1260 0.1720 -1.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8690 -0.3510 -2.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1610 0.4380 -2.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9540 -0.0980 -3.9980 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1440 -1.1690 -3.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2930 0.6430 -4.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2060 -0.0130 -5.1290 C 0 0 3 0 0 0 0 0 0 0 0 0 6.9000 0.1120 -6.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0300 -1.2140 -4.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6020 0.1010 -4.8220 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1940 0.0980 -5.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6690 1.2320 -5.5020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 1.9780 0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0020 1.4370 -0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 1.5510 0.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 -0.1340 2.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 -1.3590 1.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6350 0.3510 1.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8630 -0.9970 -0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9730 -2.1400 0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8890 -0.8200 1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0940 -1.6820 -0.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 -0.5510 -1.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8960 1.2330 -1.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7850 0.0950 -0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1090 -1.4120 -2.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2130 -0.2790 -3.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9220 1.5000 -2.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7880 0.3730 -1.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1350 1.6850 -4.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7880 0.6790 -3.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8920 -1.6530 -3.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2870 -1.9160 -5.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2040 -0.9110 -6.0850 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 21 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 4 24 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 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 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 16 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 M CHG 1 39 -1 M END