PUBCHEM-ZINC03040752 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 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 0.1180 3.9420 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8060 4.0840 -1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0110 4.2010 1.4870 S 0 0 0 0 0 0 0 0 0 0 0 0 1.6240 5.9730 1.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2890 6.6420 2.6890 C 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 2.7310 3.8120 -1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9970 6.4250 0.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 6.1080 1.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9150 6.1900 3.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3680 6.5060 2.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9770 8.2290 2.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9750 8.0770 2.6870 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 8.5420 3.4730 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 16 1 0 0 0 0 2 3 2 0 0 0 0 2 17 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 18 1 0 0 0 0 5 6 1 0 0 0 0 5 19 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 10 1 0 0 0 0 9 20 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 21 1 0 0 0 0 11 22 1 0 0 0 0 12 23 1 0 0 0 0 12 24 1 0 0 0 0 12 26 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 M CHG 1 13 1 M CHG 1 15 -1 M END