PUBCHEM-ZINC05678268 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 34 0 0 1 0 0 0 0 0999 V2000 -0.5900 1.4380 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2720 -0.0350 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 -0.6880 1.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3920 -2.0520 1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3120 -2.7470 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -2.0940 -1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3540 -0.7430 -1.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7530 -0.0540 -2.4150 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.9350 -0.6960 -3.4340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9010 1.1550 -2.4220 O 0 5 0 0 0 0 0 0 0 0 0 0 0.6220 -4.1940 -0.0590 N 0 3 0 0 0 0 0 0 0 0 0 0 0.9480 -4.7700 0.9640 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5520 -4.8090 -1.1080 O 0 5 0 0 0 0 0 0 0 0 0 0 0.1830 0.0630 2.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 1.2720 2.4630 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4030 -0.5920 3.6190 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4860 0.1520 4.8780 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1980 1.0000 4.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -0.7670 6.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7350 -0.1930 7.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2970 0.5380 6.7280 S 0 0 0 0 0 0 0 0 0 0 0 0 1.8910 0.6550 5.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6160 1.0740 4.1870 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3110 2.0070 -0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3550 1.6550 -0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9570 1.7160 1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6800 -2.5630 2.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1180 -2.6430 -2.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5050 -1.5570 3.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9990 -0.7780 6.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4520 -1.7770 5.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 0.5720 7.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9310 -0.9890 8.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 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 14 1 0 0 0 0 4 5 1 0 0 0 0 4 27 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 28 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 29 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 22 1 0 0 0 0 19 20 1 0 0 0 0 19 30 1 0 0 0 0 19 31 1 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 M CHG 1 8 1 M CHG 1 10 -1 M CHG 1 11 1 M CHG 1 13 -1 M END