PUBCHEM-ZINC05113179 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 27 0 0 1 0 0 0 0 0999 V2000 -0.0890 1.5240 -0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 -0.0050 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5250 -0.5650 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3450 2.0640 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4460 3.5950 0.0160 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8130 4.0410 0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 4.0380 0.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5510 4.5260 -0.6900 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3960 3.8760 1.4930 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7310 4.2890 1.6830 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 1.8130 -1.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6900 1.9650 0.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4960 -0.4440 -0.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3620 -0.2980 1.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1470 -0.1910 0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0080 -0.3540 -0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8120 1.6760 0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9330 1.6550 -0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9230 3.4990 2.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9840 4.6400 0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4700 -2.0410 0.1440 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.4120 -2.4540 0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0490 -2.3230 1.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9190 -2.4770 -0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9560 4.1420 -1.2950 N 0 3 0 0 0 0 0 0 0 0 0 0 1.0890 5.1650 -1.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 3.9480 -1.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5330 3.7820 -2.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 11 1 0 0 0 0 1 12 1 0 0 0 0 2 3 1 0 0 0 0 2 13 1 0 0 0 0 2 14 1 0 0 0 0 3 15 1 0 0 0 0 3 16 1 0 0 0 0 3 21 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 7 1 0 0 0 0 5 25 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 19 1 0 0 0 0 10 20 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 M CHG 1 21 1 M CHG 1 25 1 M END