PUBCHEM-ZINC02003024 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 0 0 0 0 0 0999 V2000 0.7270 0.4250 -0.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0980 -0.6770 -0.4360 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6130 -0.4500 0.0970 P 0 0 0 0 0 0 0 0 0 0 0 0 -2.0550 1.1810 1.0650 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.4800 -0.7100 -1.2540 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3170 0.1370 -2.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9020 -1.8390 0.8820 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2650 -2.2740 2.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8300 -3.3870 2.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2510 -3.9160 3.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 -3.3190 4.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4900 -2.1980 3.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1140 -1.6900 2.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6990 -1.5070 4.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 -1.5420 5.5320 O 0 5 0 0 0 0 0 0 0 0 0 0 0.5070 -3.9590 5.4770 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.1500 -3.9480 6.5290 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5680 -4.5740 5.2930 O 0 5 0 0 0 0 0 0 0 0 0 0 1.5850 0.0630 -1.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 1.1580 -1.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0920 0.8940 0.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.0900 -2.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1350 -0.0500 -3.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3420 1.1890 -2.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7240 -3.8460 2.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6950 -4.7890 4.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3510 -0.8270 2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4600 -0.9240 3.4440 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 3 7 1 0 0 0 0 5 6 1 0 0 0 0 6 22 1 0 0 0 0 6 23 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 25 1 0 0 0 0 10 11 1 0 0 0 0 10 26 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 28 2 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 M CHG 1 15 -1 M CHG 1 16 1 M CHG 1 18 -1 M END