PUBCHEM-ZINC05041603 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 30 0 0 0 0 0 0 0 0999 V2000 -0.2290 1.5090 -0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 0.0050 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1960 -0.6460 1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2730 -2.0240 1.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -2.7580 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3360 -2.1020 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4160 -0.7230 -1.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6190 -2.8790 -2.4330 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.8220 -2.3020 -3.4860 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 -4.0960 -2.3890 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0850 -4.1540 -0.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3780 -4.8350 1.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1200 -3.9960 2.3570 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.2560 -6.1760 1.1100 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7580 -6.9170 2.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 -8.3890 2.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 -9.0630 2.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7430 1.9220 -0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9710 1.8180 -0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5210 1.8750 0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4020 -0.0750 1.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5400 -2.5320 2.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6860 -0.2120 -2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 -4.6320 -0.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1650 -6.6520 0.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 -6.5740 3.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8300 -6.7460 2.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8620 -8.8880 1.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3460 -10.1180 2.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5230 -8.5630 3.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 22 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 23 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 11 12 1 0 0 0 0 11 24 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 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 15 27 1 0 0 0 0 16 17 2 0 0 0 0 16 28 1 0 0 0 0 17 29 1 0 0 0 0 17 30 1 0 0 0 0 M CHG 1 8 1 M CHG 1 10 -1 M END