PUBCHEM-ZINC05377716 MOE2007 3D CORINA 3.40 0006 02.08.2006 23 22 0 0 1 0 0 0 0 0999 V2000 3.3300 -0.9830 -5.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7320 -0.7660 -4.1030 S 0 0 0 0 0 0 0 0 0 0 0 0 4.1380 0.2270 -3.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3900 -0.5980 -3.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2640 -1.8540 -3.2590 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6300 0.6260 -4.5270 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9380 1.3380 -2.9860 S 0 0 0 0 0 0 0 0 0 0 0 0 1.7290 2.9650 -3.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6830 1.7810 -3.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4490 2.3330 -2.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8630 2.1770 -1.3690 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5060 -1.2950 -6.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0990 -1.7470 -5.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3680 1.0040 -4.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8530 0.7160 -2.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 0.2420 -5.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6450 3.3180 -4.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 3.6950 -2.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7870 2.8920 -2.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6100 2.5130 -4.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1930 0.8870 -4.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4300 0.0900 -3.0160 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.5540 2.8740 -2.7470 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 12 1 0 0 0 0 1 13 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 14 1 0 0 0 0 3 15 1 0 0 0 0 4 5 2 0 0 0 0 4 22 1 0 0 0 0 6 7 2 0 0 0 0 6 16 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 17 1 0 0 0 0 8 18 1 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 9 20 1 0 0 0 0 9 21 1 0 0 0 0 10 11 2 0 0 0 0 10 23 1 0 0 0 0 M CHG 1 22 -1 M CHG 1 23 -1 M END