PUBCHEM-ZINC00998824 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 0 0 0 0 0 0999 V2000 -0.0890 1.2810 -0.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 0.0000 -1.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3350 -0.5990 -1.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4500 0.0770 -0.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7270 -0.5090 -0.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8340 0.1680 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 1.4500 0.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4020 2.0490 0.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2850 1.3770 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0090 1.9660 -0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0090 -0.5300 -0.1160 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1690 0.0960 0.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3460 -0.8350 0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7350 -1.2450 -1.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8320 -2.0930 -1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5600 -2.5420 -0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1790 -2.1350 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0780 -1.2870 1.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7150 -3.4200 -0.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0910 -3.7370 -1.4530 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3010 -3.8190 0.8310 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4860 -4.6120 0.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0800 -4.9630 1.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3890 -5.5390 4.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2600 -6.1210 5.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9630 -7.5670 4.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6940 -7.6980 3.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8260 -7.1120 2.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0710 1.7480 -0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7810 -0.5340 -1.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4400 -1.6010 -1.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8730 -1.5100 -0.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4940 2.0160 0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2960 3.0510 0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8620 2.9660 0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3900 1.0330 -0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0120 0.3030 1.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1800 -0.9060 -1.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1120 -2.3950 -2.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7260 -2.4560 2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7990 -0.9800 2.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2360 -5.5170 0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2210 -4.0300 0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9600 -5.6080 1.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3470 -4.0370 2.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5120 -4.4740 4.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3370 -6.0610 4.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5250 -6.0660 6.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3540 -5.5160 5.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8150 -8.2000 5.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0980 -7.9290 5.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5600 -8.7550 3.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7540 -7.1890 3.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7690 -7.6480 2.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5630 -7.1370 1.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0480 -5.6670 2.8680 N 0 3 0 0 0 0 0 0 0 0 0 0 12.1650 -5.1570 2.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 23 56 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 24 56 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 56 1 M END