NCID-ZINC05432850
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 18 18  0  0  1  0  0  0  0  0999 V2000
   -0.0190    1.5410    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
    1.4430   -0.3320   -0.4400 C   0  0  3  0  0  0  0  0  0  0  0  0
    2.1030    0.9460   -0.6680 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4520    1.9160   -0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9450    2.9010    0.4950 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1670   -1.1080    0.6620 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0460   -1.3760    0.1490 Br  0  0  0  0  0  0  0  0  0  0  0  0
    1.4230   -1.1380   -1.7130 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4550   -1.8050   -1.9900 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5200    1.9230   -0.8790 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5020    1.9130    0.9140 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1940   -0.3970    1.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7190   -0.3950   -0.7160 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1220   -0.5430    1.5940 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6860   -2.0760    0.8010 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4810   -1.1140   -2.5390 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4220   -1.6480   -3.3440 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  5  1  0  0  0  0
  1 11  1  0  0  0  0
  1 12  1  0  0  0  0
  2  3  1  0  0  0  0
  2 13  1  0  0  0  0
  2 14  1  0  0  0  0
  3  4  1  0  0  0  0
  3  7  1  0  0  0  0
  3  9  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  7  8  1  0  0  0  0
  7 15  1  0  0  0  0
  7 16  1  0  0  0  0
  9 10  2  0  0  0  0
  9 17  1  0  0  0  0
 17 18  1  0  0  0  0
M  END