PUBCHEM-ZINC05826957
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 13 12  0  0  0  0  0  0  0  0999 V2000
    0.3080    0.7550    1.8340 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0920   -0.3070    1.1380 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8570   -0.6550   -0.1410 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6570   -1.6700   -0.9640 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9090   -1.5150   -0.9800 O   0  5  0  0  0  0  0  0  0  0  0  0
    2.2270   -0.9360    1.9780 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0500   -0.0990    2.4560 O   0  5  0  0  0  0  0  0  0  0  0  0
   -1.0160   -0.0630    3.0030 Br  0  0  0  0  0  0  0  0  0  0  0  0
    0.9280    1.4080    2.4540 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2560    1.3830    1.1370 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0250   -0.2050   -0.6780 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9350   -2.4700   -1.6310 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1290   -2.1790    2.1870 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  8  1  0  0  0  0
  1  9  1  0  0  0  0
  1 10  1  0  0  0  0
  2  3  2  0  0  0  0
  2  6  1  0  0  0  0
  3  4  1  0  0  0  0
  3 11  1  0  0  0  0
  4  5  1  0  0  0  0
  4 12  2  0  0  0  0
  6  7  1  0  0  0  0
  6 13  2  0  0  0  0
M  CHG  1   5  -1
M  CHG  1   7  -1
M  END