PUBCHEM-ZINC04477522 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 29 0 0 1 0 0 0 0 0999 V2000 0.1090 1.3040 0.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0980 -0.0930 0.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -0.7910 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3520 -0.1040 -0.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3530 1.2930 -0.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2360 2.0150 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 3.5380 -0.0110 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2550 3.8460 -0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3470 4.0880 1.4340 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5390 3.7360 2.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4050 5.6190 1.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4510 6.0620 0.5400 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2630 5.6690 -1.0150 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8700 6.0620 -1.4060 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2750 4.0660 -0.8210 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -2.2550 -0.0360 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1870 -2.8250 0.3470 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2470 -2.8350 -0.4080 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.7820 1.8300 0.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7910 -0.6130 0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2300 -0.6320 -0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2380 1.8060 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4440 6.0500 1.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6210 6.0100 2.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6310 3.5910 2.0630 N 0 3 0 0 0 0 0 0 0 0 0 0 3.4470 3.8960 1.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6600 2.5620 2.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7570 3.9440 3.0210 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 19 1 0 0 0 0 2 3 2 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 16 1 0 0 0 0 4 5 2 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 22 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 15 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 25 1 0 0 0 0 11 12 1 0 0 0 0 11 23 1 0 0 0 0 11 24 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M CHG 1 25 1 M END