PUBCHEM-ZINC06491778 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 29 0 0 1 0 0 0 0 0999 V2000 -0.1190 1.5340 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 0.0080 -0.0220 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0650 -0.4120 -0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 -0.5360 1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3630 -0.8010 2.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8870 -0.4980 3.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7010 -0.4790 -1.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9100 -0.7010 -1.1650 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -0.6580 -2.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 -1.0430 -3.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3600 -1.1360 -4.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6330 -0.8210 -4.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6840 -0.4210 -2.7220 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8780 1.9720 0.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 1.9130 -0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 1.9130 0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7550 -1.6300 1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -0.1200 1.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2620 -1.8850 2.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0340 -0.3980 1.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7390 -0.5270 3.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8260 0.0470 3.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0560 -1.5780 3.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3860 -0.1600 4.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6400 -1.2480 -3.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1140 -1.4180 -5.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5370 -0.8080 -4.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.1730 2.5260 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.1340 0.8470 2.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 7 1 0 0 0 0 4 17 1 0 0 0 0 4 18 1 0 0 0 0 4 28 1 0 0 0 0 5 19 1 0 0 0 0 5 20 1 0 0 0 0 5 21 1 0 0 0 0 5 28 1 0 0 0 0 6 22 1 0 0 0 0 6 23 1 0 0 0 0 6 24 1 0 0 0 0 6 28 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 11 12 2 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 28 29 1 0 0 0 0 M CHG 1 28 1 M END