CHEMDIV-ZINC00196209 MOE2007 3D CORINA 3.40 0006 02.08.2006 19 19 0 0 1 0 0 0 0 0999 V2000 -0.1060 1.5370 -0.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 0.0350 -0.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0170 -0.4870 -0.9860 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0760 -0.6820 -0.0410 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3030 -0.1060 0.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5540 -1.4100 0.4900 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.4410 -2.6770 -0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0320 -2.1510 0.0480 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3580 -2.5360 -0.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5140 -2.7300 1.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3440 -1.9040 2.3360 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8630 1.9860 -0.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8410 1.8870 -1.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3920 1.8580 0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1250 0.2600 1.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6300 0.7260 -0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6490 -3.6490 0.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6450 -2.7510 -1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3260 -3.9830 1.3870 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 12 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 15 1 0 0 0 0 5 16 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 17 1 0 0 0 0 7 18 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 19 1 0 0 0 0 M CHG 1 19 -1 M END