NCID-ZINC00400551
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 17 17  0  0  0  0  0  0  0  0999 V2000
   -0.0170    1.3770    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
    1.2110   -0.6830   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4130    0.0380   -0.0210 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3800    1.4340   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1690    2.0940    0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1260    3.9840    0.0130 Br  0  0  0  0  0  0  0  0  0  0  0  0
    3.7050   -0.6740   -0.0370 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7290   -1.8890   -0.0430 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8580    0.0240   -0.0440 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2300   -2.0390   -0.0200 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9610    1.9010    0.0170 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9260   -0.5560    0.0080 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3020    1.9970   -0.0180 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8390    0.9930   -0.0390 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7080   -0.4450   -0.0540 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2280   -2.4280   -0.9060 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 12  1  0  0  0  0
  2  3  2  0  0  0  0
  2 13  1  0  0  0  0
  3  4  1  0  0  0  0
  3 11  1  0  0  0  0
  4  5  2  0  0  0  0
  4  8  1  0  0  0  0
  5  6  1  0  0  0  0
  5 14  1  0  0  0  0
  6  7  1  0  0  0  0
  8  9  2  0  0  0  0
  8 10  1  0  0  0  0
 10 15  1  0  0  0  0
 10 16  1  0  0  0  0
 11 17  1  0  0  0  0
M  END