PUBCHEM-ZINC04543549 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3770 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 -0.6800 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 0.0340 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 1.4140 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 3.5660 0.0100 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0830 4.1590 0.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1930 4.1910 0.0040 O 0 5 0 0 0 0 0 0 0 0 0 0 3.6970 -0.6850 -0.0370 N 0 3 0 0 0 0 0 0 0 0 0 0 4.7420 -0.0580 -0.0430 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7180 -1.9020 -0.0430 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2340 -2.0390 -0.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -2.7070 -0.0110 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6510 -2.2980 0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1870 -4.2040 0.2290 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6420 -4.3530 1.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1650 -4.9220 0.1770 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8030 -4.5550 0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8290 -4.6400 -1.1740 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8160 -5.1020 -1.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9670 -3.1270 -1.3600 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6150 -2.7220 -0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6780 -2.5170 -1.2700 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5750 -2.8350 -2.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8120 -1.4320 -2.8610 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0230 -5.1800 -2.2240 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 -6.3280 0.3300 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0300 -4.7200 -0.7610 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9700 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8850 -3.1600 -3.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5170 -3.3730 -2.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1970 -1.1740 -3.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8900 -6.1360 -2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 -6.5780 1.1630 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 13 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 24 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 29 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 28 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 27 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 25 33 1 0 0 0 0 25 34 1 0 0 0 0 26 35 1 0 0 0 0 27 36 1 0 0 0 0 28 37 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M CHG 1 10 1 M CHG 1 12 -1 M END