PUBCHEM-ZINC05495272 MOE2007 3D CORINA 3.40 0006 02.08.2006 25 25 0 0 0 0 0 0 0 0999 V2000 1.7660 0.6270 -3.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4040 1.2690 -3.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2790 2.4510 -3.8150 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 0.5100 -3.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9400 1.1170 -3.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0030 0.3960 -2.6540 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0800 2.4500 -3.3310 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9930 2.8770 -4.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0940 4.2270 -4.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9940 4.6480 -5.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7980 3.7210 -6.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6950 2.3710 -5.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7920 1.9500 -4.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6810 -0.4280 -3.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1760 0.7220 -4.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4290 1.1240 -2.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6140 -0.5560 -3.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8270 0.8780 -2.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5470 3.1010 -2.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4700 4.9470 -4.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0740 5.6970 -5.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3200 1.6510 -6.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7090 0.9000 -4.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9470 4.2580 -7.4500 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.2270 4.2070 -8.5850 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 2 0 0 0 0 4 17 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 18 1 0 0 0 0 7 8 1 0 0 0 0 7 19 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 20 1 0 0 0 0 10 11 1 0 0 0 0 10 21 1 0 0 0 0 11 12 2 0 0 0 0 11 24 1 0 0 0 0 12 13 1 0 0 0 0 12 22 1 0 0 0 0 13 23 1 0 0 0 0 24 25 1 0 0 0 0 M END