PUBCHEM-ZINC06361547 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 31 0 0 1 0 0 0 0 0999 V2000 -0.2910 1.7640 -0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 0.2690 -0.0460 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2800 -0.0990 0.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3730 0.1240 -0.2340 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0130 1.4370 -0.0730 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 2.3080 0.4740 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9690 2.2380 1.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 4.0360 -0.0210 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8390 4.3620 0.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3730 5.7070 0.2410 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8490 6.5650 0.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8810 5.7210 0.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5330 5.7510 -0.5400 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7870 -0.5090 -1.1370 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2600 -0.4650 -2.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8490 -1.9780 -0.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8360 -2.2120 0.1440 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4150 2.0810 -1.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 2.0620 0.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1670 1.6730 -1.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7390 4.3590 1.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5290 3.5590 0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2300 5.6990 1.7620 O 0 5 0 0 0 0 0 0 0 0 0 0 3.2410 5.8190 -1.2690 N 0 3 0 0 0 0 0 0 0 0 0 0 2.9310 6.7430 -1.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6760 5.0630 -1.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2620 5.7220 -1.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -2.7460 -1.0360 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.1900 -0.0380 -1.3120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6940 -0.4730 -0.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5820 -0.5460 -2.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 14 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 20 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 21 1 0 0 0 0 9 22 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 24 1 0 0 0 0 12 13 2 0 0 0 0 12 23 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 29 1 0 0 0 0 16 17 2 0 0 0 0 16 28 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 M CHG 1 23 -1 M CHG 1 24 1 M CHG 1 28 -1 M END