PUBCHEM-ZINC05568388
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 17 18  0  0  0  0  0  0  0  0999 V2000
   -0.0170    1.3960    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
    1.1630   -0.7060   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3880   -0.0130   -0.0210 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3680    1.4700   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1250    2.1280    0.0030 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6440    1.7780   -0.0230 N   0  3  0  0  0  0  0  0  0  0  0  0
    4.2990    0.7540   -0.0350 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6720   -0.2860   -0.0340 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.1730    3.0910   -0.0220 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.1410   -2.2120   -0.0200 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1140   -2.8580   -1.8770 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -0.9680    1.9070    0.0170 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9350   -0.5410    0.0080 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0800    3.2080    0.0090 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0310   -2.5910    0.4830 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2510   -2.5650    0.5000 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 11  1  0  0  0  0
  4  5  1  0  0  0  0
  4  9  2  0  0  0  0
  5  6  1  0  0  0  0
  5  7  2  0  0  0  0
  6 15  1  0  0  0  0
  7  8  1  0  0  0  0
  7 10  1  0  0  0  0
  8  9  1  0  0  0  0
 11 12  1  0  0  0  0
 11 16  1  0  0  0  0
 11 17  1  0  0  0  0
M  CHG  1   7   1
M  CHG  1  10  -1
M  END