PUBCHEM-ZINC05420172 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 28 0 0 1 0 0 0 0 0999 V2000 -0.1500 1.0660 0.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.4360 0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -0.6480 -1.0660 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8760 -1.9240 -1.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5070 -2.1990 -2.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8410 -3.5800 -3.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4740 -4.4960 -2.2880 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5550 -3.8370 -4.1140 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8480 -3.1070 -4.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8890 -5.2190 -4.4670 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0670 -5.7940 -3.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7280 -5.8410 -5.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1310 -5.2330 -5.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6800 -4.1950 -5.6060 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8150 -1.1890 -3.4960 N 0 3 0 0 0 0 0 0 0 0 0 0 2.0490 -0.4190 -4.1440 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4740 -2.9330 -0.6460 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8360 1.5300 0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7430 1.5110 -0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 1.2250 1.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 -0.8820 1.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9860 -0.9010 0.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5500 -5.2660 -6.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9770 -6.8690 -5.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7190 -3.8290 -0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6260 -6.3980 -5.7670 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2340 -5.8250 -4.2170 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.6890 -6.3920 -5.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4240 -6.3560 -6.3110 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 21 1 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 17 1 0 0 0 0 5 6 1 0 0 0 0 5 15 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 12 23 1 0 0 0 0 12 24 1 0 0 0 0 12 27 1 0 0 0 0 13 14 2 0 0 0 0 13 26 1 0 0 0 0 15 16 3 0 0 0 0 17 25 1 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 M CHG 1 15 1 M END