PUBCHEM-ZINC04096345 MOE2007 3D CORINA 3.40 0006 02.08.2006 26 26 0 0 1 0 0 0 0 0999 V2000 -0.4230 1.8640 -0.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4030 0.4210 -0.1190 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7580 -0.4780 -1.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 -1.8950 -1.3930 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0190 -1.8970 -0.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8560 -2.5370 -2.6520 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3570 -1.8370 -3.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 -3.2010 -3.2650 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0590 -2.4900 -3.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 -3.6790 -2.0310 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2270 -4.6580 -1.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1650 -2.7220 -0.9860 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5010 -3.7260 -2.3250 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0010 -5.0700 -3.1280 P 0 0 0 0 0 0 0 0 0 0 0 0 -0.9630 -5.2190 -4.2450 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0720 -4.2680 -4.1170 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 -4.7810 -4.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8130 -3.5520 -2.3190 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6580 -4.2460 -3.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 2.3870 -1.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3300 1.5630 -1.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7020 2.5510 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 -0.5180 -2.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5060 0.1030 -2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9330 -6.1670 -2.0780 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.3980 -4.7120 -3.6070 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 3 24 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 8 1 0 0 0 0 6 18 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 16 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 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 25 1 0 0 0 0 14 26 1 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 M CHG 1 25 -1 M CHG 1 26 -1 M END