PUBCHEM-ZINC06761074 MOE2007 3D CORINA 3.40 0006 02.08.2006 23 23 0 0 1 0 0 0 0 0999 V2000 0.0470 1.4330 0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2350 -0.0820 0.2060 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7360 -0.5520 0.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 -0.4570 1.3040 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5470 -1.5030 1.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4930 0.4120 1.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1880 1.8100 1.1630 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3990 2.1380 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9360 1.7920 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2900 3.6810 -0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3580 4.2670 -0.4820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6240 -0.2620 2.5800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1970 -1.5770 3.4500 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.4550 -1.0160 4.6300 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6980 -2.3130 2.5590 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7080 -0.5790 -1.0520 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -0.3640 -1.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5710 1.6820 -0.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4820 1.7780 1.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1040 0.2650 2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1040 0.1450 0.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 4.1860 0.0780 O 0 5 0 0 0 0 0 0 0 0 0 0 1.4680 -2.2440 3.7190 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 8 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 16 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 12 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 6 21 1 0 0 0 0 7 8 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 22 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 23 1 0 0 0 0 16 17 1 0 0 0 0 M CHG 1 22 -1 M CHG 1 23 -1 M END