PUBCHEM-ZINC06092157 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 22 0 0 0 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 4.1580 0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1930 4.1910 0.0030 O 0 5 0 0 0 0 0 0 0 0 0 0 3.7210 -0.6980 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2340 -0.9820 -1.7530 S 0 0 0 0 0 0 0 0 0 0 0 0 3.3690 -1.9170 -2.3840 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5690 0.2460 -2.3840 O 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 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4750 -0.0980 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6120 -1.6550 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5600 -1.7190 -1.6360 O 0 0 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 1.2320 -2.4280 -0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9630 -1.9420 -2.4870 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 14 1 0 0 0 0 2 3 2 0 0 0 0 2 15 1 0 0 0 0 3 4 1 0 0 0 0 3 20 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 16 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 1 0 0 0 0 10 17 1 0 0 0 0 10 18 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 19 1 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M END