PUBCHEM-ZINC02029561
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 18 18  0  0  0  0  0  0  0  0999 V2000
    0.8890    2.1510    1.5940 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4890    0.9210    1.1040 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4270    0.0260    0.6310 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7810    0.3640    0.6480 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1770    1.6060    1.1440 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2300    2.4930    1.6130 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7900   -0.5910    0.1440 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7260   -0.1810   -0.7030 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6170    1.1520   -1.3370 N   0  3  0  0  0  0  0  0  0  0  0  0
    3.6160    1.8260   -1.1720 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5290    1.5750   -2.0250 O   0  5  0  0  0  0  0  0  0  0  0  0
    6.1980   -1.3000   -1.0990 Br  0  0  0  0  0  0  0  0  0  0  0  0
    0.1510    2.8500    1.9580 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5590    0.6600    1.0910 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1140   -0.9350    0.2500 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2230    1.8740    1.1600 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5350    3.4550    1.9970 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7670   -1.6220    0.4660 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  6  2  0  0  0  0
  1 13  1  0  0  0  0
  2  3  2  0  0  0  0
  2 14  1  0  0  0  0
  3  4  1  0  0  0  0
  3 15  1  0  0  0  0
  4  5  2  0  0  0  0
  4  7  1  0  0  0  0
  5  6  1  0  0  0  0
  5 16  1  0  0  0  0
  6 17  1  0  0  0  0
  7  8  2  0  0  0  0
  7 18  1  0  0  0  0
  8  9  1  0  0  0  0
  8 12  1  0  0  0  0
  9 10  2  0  0  0  0
  9 11  1  0  0  0  0
M  CHG  1   9   1
M  CHG  1  11  -1
M  END