PUBCHEM-ZINC05138235 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 26 0 0 0 0 0 0 0 0999 V2000 0.4300 1.4760 0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 -0.0280 0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6540 -0.6890 1.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 -0.3280 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1210 0.2320 -1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6260 0.9740 -2.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4390 -0.1870 -1.2120 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3590 0.2240 -2.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7510 -0.3130 -1.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7710 0.0860 -3.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3410 0.7710 -4.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0850 -0.7660 -1.2490 S 0 0 0 0 0 0 0 0 0 0 0 0 1.4890 1.6660 0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1890 2.0000 -0.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1490 1.9490 1.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 -0.2790 2.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 -1.7720 1.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7280 -0.5170 1.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5390 -1.4150 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8900 0.0670 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7870 -0.8000 -0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3540 1.3190 -2.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9630 -0.1480 -3.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7250 -1.4080 -1.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1090 0.0490 -1.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 -1.9820 -1.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9420 -0.3320 -2.8240 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 12 1 0 0 0 0 3 16 1 0 0 0 0 3 17 1 0 0 0 0 3 18 1 0 0 0 0 4 5 1 0 0 0 0 4 19 1 0 0 0 0 4 20 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 9 24 1 0 0 0 0 9 25 1 0 0 0 0 10 11 2 0 0 0 0 10 27 1 0 0 0 0 12 26 1 0 0 0 0 M CHG 1 27 -1 M END