PUBCHEM-ZINC04097497 MOE2007 3D CORINA 3.40 0006 02.08.2006 25 25 0 0 1 0 0 0 0 0999 V2000 0.0090 1.4730 0.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 0.0460 -0.0580 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7680 -0.7220 0.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1700 -0.8740 0.2890 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6870 -1.7490 0.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8100 -1.0670 -1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5810 -0.1520 -1.3910 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8920 0.8070 -1.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4160 -0.8110 -2.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -1.8600 -1.9940 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9520 0.3070 0.4800 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 -0.4350 -0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0420 1.8220 0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 2.0390 -0.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4430 1.6170 1.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8380 -0.1720 1.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3180 -1.7010 1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6320 -0.7420 -1.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5510 -2.1060 -1.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8370 0.2590 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9380 0.0060 -0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4140 -1.5210 -0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8960 -0.1480 0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7380 -0.2320 -3.4760 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3830 -0.6920 -4.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 12 1 0 0 0 0 3 4 1 0 0 0 0 3 16 1 0 0 0 0 3 17 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 11 1 0 0 0 0 6 7 1 0 0 0 0 6 18 1 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 24 1 0 0 0 0 11 20 1 0 0 0 0 12 21 1 0 0 0 0 12 22 1 0 0 0 0 12 23 1 0 0 0 0 24 25 1 0 0 0 0 M CHG 1 2 1 M END