NCID-ZINC01596249
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 17 17  0  0  0  0  0  0  0  0999 V2000
   -0.1610    1.5280    0.0820 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0660    0.0280   -0.0070 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0460   -0.7050    1.1900 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1240   -2.0970    1.1780 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0930   -2.7730   -0.0350 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0060   -2.0680   -1.2330 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0760   -0.6590   -1.2440 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1620    0.0390   -2.5880 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3370    1.2030   -2.6880 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.1910   -4.6620   -0.0600 Br  0  0  0  0  0  0  0  0  0  0  0  0
    0.7810    1.9890   -0.2320 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9870    1.9030   -0.5310 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3620    1.8530    1.1090 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0670   -0.1870    2.1470 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2050   -2.6370    2.1170 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0270   -2.6040   -2.1810 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7150   -0.6110   -3.5310 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 11  1  0  0  0  0
  1 12  1  0  0  0  0
  1 13  1  0  0  0  0
  2  3  1  0  0  0  0
  2  7  2  0  0  0  0
  3  4  2  0  0  0  0
  3 14  1  0  0  0  0
  4  5  1  0  0  0  0
  4 15  1  0  0  0  0
  5  6  2  0  0  0  0
  5 10  1  0  0  0  0
  6  7  1  0  0  0  0
  6 16  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 17  2  0  0  0  0
M  CHG  1   9  -1
M  END