PUBCHEM-ZINC05298694 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 28 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8080 -1.2230 -0.8970 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2360 -0.2170 1.0330 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9200 0.3410 1.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6110 -0.7240 1.0440 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9920 -0.7600 0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6310 -2.1300 1.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5880 -3.2300 0.6490 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.4770 0.1900 1.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9960 1.1640 2.3990 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8510 -0.5890 -1.4900 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5080 0.1300 -1.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2490 -2.0940 2.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6540 -2.5080 1.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6990 -4.4100 1.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9730 -0.2350 -0.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1170 -0.1600 -2.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4310 1.2160 -1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7830 -0.0790 2.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2980 0.5360 2.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 14 1 0 0 0 0 3 19 1 0 0 0 0 3 20 1 0 0 0 0 3 21 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 10 11 1 0 0 0 0 10 22 1 0 0 0 0 10 23 1 0 0 0 0 11 24 1 0 0 0 0 12 13 2 0 0 0 0 12 28 1 0 0 0 0 14 15 1 0 0 0 0 15 25 1 0 0 0 0 15 26 1 0 0 0 0 15 27 1 0 0 0 0 28 29 1 0 0 0 0 M END