PUBCHEM-ZINC02169804 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 21 0 0 1 0 0 0 0 0999 V2000 -0.2130 1.5200 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 0.0170 -0.0420 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5420 -0.2310 -0.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.6730 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5930 -1.3570 1.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -0.4570 1.0730 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1990 -0.2250 1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8770 0.4180 0.4100 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8010 -0.8210 2.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7980 -1.8570 3.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 2.0710 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8210 1.8780 -0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7310 1.7870 0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3180 -1.0130 1.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9520 0.0080 3.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1120 -1.5430 2.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2190 -2.5590 3.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0530 -0.9830 3.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7310 -2.3550 3.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0980 -0.4820 -1.0390 O 0 5 0 0 0 0 0 0 0 0 0 0 4.0710 -1.4790 2.1470 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6280 -0.8270 1.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 11 1 0 0 0 0 1 12 1 0 0 0 0 1 13 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 20 1 0 0 0 0 6 7 1 0 0 0 0 6 14 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 15 1 0 0 0 0 9 16 1 0 0 0 0 9 21 1 0 0 0 0 10 17 1 0 0 0 0 10 18 1 0 0 0 0 10 19 1 0 0 0 0 10 21 1 0 0 0 0 21 22 1 0 0 0 0 M CHG 1 20 -1 M END