PUBCHEM-ZINC00108632 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 35 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 3.5920 0.0100 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1770 3.9440 -0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4080 4.0980 1.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 5.9000 1.4710 S 0 0 0 0 0 0 0 0 0 0 0 0 1.5760 6.2020 3.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5570 7.5100 3.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8350 7.6880 5.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7510 9.0370 5.2850 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8910 9.4840 6.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4360 9.6350 4.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 8.7370 3.1660 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1030 6.6220 5.8040 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1090 5.4160 5.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8490 5.1980 4.0010 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1680 4.0870 -0.8630 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 -2.1590 -0.0200 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1820 -2.7820 -0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2910 -2.7540 -0.0340 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 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 3.3380 -0.4990 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6850 3.6500 2.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 3.8220 1.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3000 10.6970 3.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3300 4.5720 5.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0620 3.8130 -0.6200 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 21 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 20 2 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 31 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 21 33 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END