PUBCHEM-ZINC05849494 MOE2007 3D CORINA 3.40 0006 02.08.2006 19 19 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5270 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7940 -0.5030 1.2140 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2980 -0.1820 2.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2080 0.0810 1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 1.5480 1.1790 N 0 5 0 0 0 0 0 0 0 0 0 0 1.4190 2.0520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 -2.0070 1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3430 -2.6190 0.2820 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8890 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8790 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0190 -0.3820 0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4770 -0.3570 -0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7700 -0.2600 2.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7090 -0.2510 0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9230 1.7110 -0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4080 3.1420 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5200 -2.6680 2.1520 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5410 -3.6330 2.0880 H 0 0 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 10 1 0 0 0 0 1 11 1 0 0 0 0 2 3 1 0 0 0 0 2 12 1 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 8 1 0 0 0 0 5 6 1 0 0 0 0 5 14 1 0 0 0 0 5 15 1 0 0 0 0 6 7 1 0 0 0 0 7 16 1 0 0 0 0 7 17 1 0 0 0 0 8 9 2 0 0 0 0 8 18 1 0 0 0 0 18 19 1 0 0 0 0 M CHG 1 6 -1 M END