PUBCHEM-ZINC05134384 MOE2007 3D CORINA 3.40 0006 02.08.2006 23 23 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.4850 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -0.0290 -0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -0.7250 -1.2630 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2930 0.5290 -2.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2570 1.6870 -2.3090 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2570 1.3610 -2.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3580 2.1310 0.1320 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1360 1.4210 0.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4980 3.3050 1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2150 4.2370 0.6560 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2940 2.4100 -3.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5010 3.4030 -3.7160 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6160 1.9450 -0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 1.6750 0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1630 -0.5140 0.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9790 -0.3610 -0.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6110 -0.0140 -3.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2720 0.8760 -2.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7360 2.6170 -1.2470 N 0 3 0 0 0 0 0 0 0 0 0 0 2.4250 3.3750 -1.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0080 3.1920 -1.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9300 3.1850 2.2580 O 0 5 0 0 0 0 0 0 0 0 0 0 3.0810 1.9440 -4.5440 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 7 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 2 3 1 0 0 0 0 2 15 1 0 0 0 0 2 16 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 17 1 0 0 0 0 4 18 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 5 19 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 19 1 0 0 0 0 9 10 2 0 0 0 0 9 22 1 0 0 0 0 11 12 2 0 0 0 0 11 23 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 M CHG 1 19 1 M CHG 1 22 -1 M CHG 1 23 -1 M END