PUBCHEM-ZINC04622071 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 0 0 0 0 0 0999 V2000 1.9560 1.4340 1.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9690 0.0550 1.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 -0.6800 0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4140 -0.0260 -0.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4010 1.3530 -0.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 2.0880 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1580 3.4860 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3510 4.1980 0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5630 3.4900 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7650 4.1270 0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7810 5.5810 0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4820 6.3020 0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2970 5.5570 0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9830 6.2500 0.2160 N 0 3 0 0 0 0 0 0 0 0 0 0 0.4060 6.4520 1.2700 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 6.6150 -0.8320 O 0 5 0 0 0 0 0 0 0 0 0 0 3.8510 7.5560 0.4300 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0640 7.6090 0.4750 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6520 6.5480 0.4080 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9530 3.4040 0.1620 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0880 2.6390 -1.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4770 2.3730 -1.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1890 1.5260 -0.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5380 2.4140 0.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4470 2.4360 1.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0270 2.5020 1.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2150 -2.4400 0.2230 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -2.8150 -1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6560 -3.0500 -1.9700 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5520 2.0050 1.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5790 -0.4530 1.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1860 -0.5980 -1.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2080 1.8610 -1.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3180 3.9590 -0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5430 2.4140 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5650 1.6880 -0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6190 3.2030 -1.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5040 1.8370 -2.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0030 3.3210 -1.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5260 0.7280 -0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1000 1.0950 -0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4700 2.0610 1.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6890 3.4290 0.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5350 1.5350 2.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6030 3.3060 2.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3350 2.8380 2.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7340 1.5040 0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 11 19 2 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 20 26 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 28 29 3 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M END