PUBCHEM-ZINC05862043 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 27 0 0 1 0 0 0 0 0999 V2000 -0.1450 1.6750 -0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 0.1950 0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3690 -0.3610 0.0520 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5960 -1.9550 -0.2250 P 0 0 3 0 0 0 0 0 0 0 0 0 -0.8480 -2.5200 -1.9460 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.7070 -2.6660 1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6520 -2.3470 0.1050 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.8200 -4.1440 0.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5790 -4.6540 1.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1270 -3.9710 2.5510 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8980 -5.9850 1.7790 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7370 -6.7170 3.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1740 -8.1890 2.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6140 -8.5240 1.7760 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8360 2.1470 -0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5130 1.8330 -1.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8480 2.1770 0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6330 -0.2950 -0.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2790 0.0510 1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0940 -2.2650 2.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8070 -3.7550 1.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3610 -2.4340 1.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8380 -4.4120 -0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1200 -4.6330 -0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2740 -6.5590 1.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6820 -6.6640 3.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3340 -6.2120 3.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0390 -8.8720 3.9710 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 18 1 0 0 0 0 2 19 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 6 20 1 0 0 0 0 6 21 1 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 12 27 1 0 0 0 0 13 14 2 0 0 0 0 13 28 1 0 0 0 0 M CHG 1 28 -1 M END