PUBCHEM-ZINC04098401 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 1 0 0 0 0 0999 V2000 0.2950 1.6580 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1070 0.1390 0.0740 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9750 -0.0420 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7300 -0.5000 1.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7970 -2.0400 1.2830 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3810 -2.3560 2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5880 -2.7050 1.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3060 -2.8460 0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7660 -2.5200 -1.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6440 -2.5670 -2.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8960 -3.0360 -2.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4360 -3.4880 -0.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5670 -3.9470 -0.8460 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5960 -3.3270 0.1390 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9820 -3.5910 1.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6830 -2.0140 -1.2470 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6830 -0.4560 -1.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5190 -2.4820 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4950 -1.9730 -0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8200 -3.9940 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5150 -4.4290 -1.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7310 -4.0010 -2.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 -1.9840 -3.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3560 1.9290 0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 2.1220 -0.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1480 2.0890 1.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7530 -0.1190 1.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 -0.1770 2.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4690 -3.7080 1.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2150 -2.1420 2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3170 -2.1560 -3.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5640 -3.0600 -3.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 -0.0590 -2.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7080 -0.0880 -1.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4600 -4.2370 0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9080 -4.5890 0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5230 -3.9980 -1.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6370 -5.5180 -1.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2970 -4.2450 -3.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7450 -4.4720 -2.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9510 -0.9290 -3.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4230 -2.5890 -4.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1240 -2.0940 -4.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5370 -2.4980 -2.4690 N 0 3 0 0 0 0 0 0 0 0 0 0 2.4700 -2.1060 -2.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 17 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 18 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 9 16 1 0 0 0 0 10 11 2 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 44 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 22 44 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 44 1 M END