HMDB0060448
     RDKit          3D
Bromobenzene-3,4-oxide
 13 14  0  0  0  0  0  0  0  0999 V2000
    3.3523   -0.3464   -0.0820 Br  0  0  0  0  0  0  0  0  0  0  0  0
    1.4385   -0.1490   -0.0256 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6351   -1.1929   -0.1126 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8475   -1.0993   -0.0747 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4540   -0.4958   -1.1586 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3917    0.2090    0.0642 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4846    1.3534    0.1591 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8271    1.1720    0.1160 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0965   -2.1631   -0.2169 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3405   -1.9943    0.3742 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4112    0.3292    0.5044 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9037    2.3471    0.2648 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4837    2.0303    0.1877 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  2  0
  8  2  1  0
  6  4  1  0
  3  9  1  0
  4 10  1  0
  6 11  1  0
  7 12  1  0
  8 13  1  0
M  END