PUBCHEM-ZINC05978179 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 53 0 0 1 0 0 0 0 0999 V2000 -0.7610 1.4120 0.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1860 0.0180 0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3270 -0.5640 1.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9060 -1.9660 1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4210 -2.5480 2.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0450 -3.9390 2.4030 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8550 -3.8830 1.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6240 -4.4490 3.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3050 -5.5880 4.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9120 -6.0720 5.6370 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0520 -7.1570 5.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0260 -5.7430 6.8680 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9100 -4.6490 6.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7660 -6.1600 8.1570 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2390 -5.8020 9.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1850 -5.6070 8.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9140 -5.9740 6.9020 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0510 -7.0580 6.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2060 -5.4710 5.7820 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2010 -5.3750 6.9250 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8530 -7.5830 8.2440 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0060 -7.9090 8.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6220 -6.3770 6.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2930 -6.0260 7.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3240 -5.1750 7.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2540 -4.8210 8.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3100 -3.3050 9.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6910 -2.6250 8.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0710 -4.8410 1.8850 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 2.0990 0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1220 1.8080 -0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6020 1.3970 1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 -0.6360 -0.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6300 0.0630 -0.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0970 0.0960 1.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4930 -0.6040 2.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1330 -2.6210 0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7260 -1.9250 0.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1610 -1.8630 3.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5820 -2.6080 3.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3870 -3.8080 4.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5590 -6.2480 3.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1490 -4.5150 8.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7410 -5.9930 9.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6280 -5.6730 6.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1490 -6.0580 5.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6980 -7.4690 6.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 -6.5020 8.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5270 -4.6890 6.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2640 -5.1690 8.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9590 -5.3200 9.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3090 -4.8100 2.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0080 -2.9160 10.2800 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 5 40 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 2 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 19 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 23 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 21 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 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 2 0 0 0 0 27 53 1 0 0 0 0 29 52 1 0 0 0 0 M CHG 1 53 -1 M END