PUBCHEM-ZINC04781179 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 59 0 0 0 0 0 0 0 0999 V2000 1.3920 0.5520 0.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3650 -0.4100 0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7930 0.1280 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9250 -1.9640 -1.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5470 -3.2860 -0.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -3.9350 0.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8080 -5.1490 0.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7530 -5.7290 -0.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0980 -5.0990 -1.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4910 -3.8840 -1.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0040 -5.5520 -2.3650 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6470 -6.7890 -2.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4350 0.3180 -2.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4990 1.2410 -2.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5620 1.0980 -3.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2210 2.3480 -3.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 3.1900 -2.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4640 2.5120 -2.1760 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7420 4.5770 -2.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6840 5.2350 -2.8160 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8040 5.1060 -1.5170 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8770 6.4790 -1.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7520 6.8150 -0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8840 6.6160 1.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8140 6.9380 2.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3610 7.4310 1.6150 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 7.6010 0.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5390 7.3080 -0.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4090 1.5450 0.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3650 0.1750 0.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6640 0.6820 1.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3880 -1.3370 0.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1800 0.1840 1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4630 -0.5270 -0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8570 1.1360 -0.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5090 -2.0570 -2.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 -1.6900 -0.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4730 -3.5080 0.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5400 -5.6470 1.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1980 -6.6730 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7650 -3.4130 -2.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2440 -6.7220 -1.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9210 -7.6060 -2.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3290 -7.0080 -2.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 0.8350 -1.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0170 -0.1620 -3.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8340 0.2070 -4.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1020 2.6180 -4.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0500 4.5080 -1.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8470 6.6380 -0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8570 7.1310 -1.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8020 6.2300 1.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8780 6.8020 3.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4250 7.9960 -0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3810 7.4740 -1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9180 -0.8030 -1.3020 N 0 3 0 0 0 0 0 0 0 0 0 0 2.7540 -1.1810 -1.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 56 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 4 56 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 45 1 0 0 0 0 13 46 1 0 0 0 0 13 56 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 47 1 0 0 0 0 16 17 2 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 17 19 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 21 49 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 27 54 1 0 0 0 0 28 55 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 56 1 M END