PUBCHEM-ZINC04551754 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 48 0 0 0 0 0 0 0 0999 V2000 0.7780 1.2940 -0.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 -0.1280 -0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3970 -0.4710 0.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1480 -1.6370 1.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -1.1720 3.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3060 -0.3040 3.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2950 0.6240 4.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5470 1.5290 4.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5880 2.7620 3.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8470 2.4790 2.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6040 2.6740 1.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8530 2.2330 -0.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 1.4310 4.5310 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4730 1.8450 5.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 1.5740 6.8290 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7230 2.6770 5.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3610 3.1450 6.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6230 3.9840 6.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9750 4.1880 5.4120 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9570 1.2180 -1.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2160 1.7410 -0.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 -0.8460 -1.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7640 -0.2790 0.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7540 0.4080 1.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2110 -0.7510 -0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0300 -2.2890 1.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7000 -2.2510 1.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8480 -0.6370 3.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1350 -2.0490 3.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1880 -0.9550 3.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4280 0.3050 2.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3130 -0.0170 5.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6210 1.9160 5.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4490 0.9230 4.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6930 3.3800 3.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4240 3.3800 3.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6140 3.1800 1.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2730 1.4780 1.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 2.1610 1.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3400 3.7400 1.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8360 1.7590 -0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8830 3.1330 -0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3610 1.7150 3.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4490 3.5410 4.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4360 2.0710 4.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6230 2.2780 7.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6420 3.7440 7.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1650 4.3760 7.6790 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 12 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 13 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 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 18 19 2 0 0 0 0 18 48 1 0 0 0 0 M CHG 1 48 -1 M END