PUBCHEM-ZINC05722838 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 1 0 0 0 0 0999 V2000 -0.4450 1.7260 0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 0.2660 -0.0160 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5620 0.0800 -0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3190 -0.6270 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4200 -1.3680 0.9940 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6850 -0.1190 1.2520 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2500 -0.7580 1.1180 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6220 -1.2260 2.4390 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2930 -1.6380 -0.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1780 0.7350 0.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6400 0.3920 0.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1820 -0.0330 -0.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5390 -0.3500 -0.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3670 -0.2460 0.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8380 0.1690 1.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4810 0.4840 1.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4350 2.3650 0.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9730 2.0450 -0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1080 1.9080 0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -0.8010 1.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8090 1.1590 -0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 1.4500 1.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5490 -0.1300 -1.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9430 -0.6840 -1.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4220 -0.4940 0.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4800 0.2420 2.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0830 0.7960 2.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0730 -0.5050 -1.0410 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 21 1 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 23 1 0 0 0 0 13 14 1 0 0 0 0 13 24 1 0 0 0 0 14 15 2 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 15 26 1 0 0 0 0 16 27 1 0 0 0 0 M CHG 1 28 -1 M END