MDPI-ZINC03844115
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 17 17  0  0  0  0  0  0  0  0999 V2000
   -0.0170    1.3830    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
    1.2100   -0.6830   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4100    0.0320   -0.0210 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3850    1.4290   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1720    2.0980    0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1470    3.4570    0.0100 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0050    2.4050   -0.0230 Br  0  0  0  0  0  0  0  0  0  0  0  0
    3.7000   -0.6860   -0.0370 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2210   -0.9760   -1.0950 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2340   -2.5740   -0.0230 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -1.1660   -0.6980    0.0100 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9600    1.9080    0.0170 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1480    3.8450    0.8950 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5130   -0.8950   -0.8710 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2990   -1.0200    1.1230 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1430   -1.4890    1.0620 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 12  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  9  1  0  0  0  0
  5  6  1  0  0  0  0
  5  8  1  0  0  0  0
  6  7  1  0  0  0  0
  7 14  1  0  0  0  0
  9 10  2  0  0  0  0
  9 16  1  0  0  0  0
 12 15  1  0  0  0  0
 16 17  1  0  0  0  0
M  END