TDT2MOL 
Cc1ccc(Br)o1
 12 12  0  0  0  0              0      
    1.9800    0.3300   -0.1500 C   0  0  0  3  0  0
    0.5000    0.1800    0.0100 C   0  0  0  0  0  0
   -0.2800   -0.8900   -0.4600 C   0  0  0  1  0  0
   -1.6100   -0.6500   -0.1000 C   0  0  0  1  0  0
   -1.6600    0.5600    0.6100 C   0  0  0  0  0  0
   -3.2100    1.3600    1.3400 Br  0  0  0  0  0  0
   -0.3600    1.0700    0.6800 O   0  0  0  0  0  0
    2.2500    0.1400   -1.2000 H   0  0  0  0  0  0
    2.5000   -0.3800    0.5000 H   0  0  0  0  0  0
    2.2700    1.3600    0.1200 H   0  0  0  0  0  0
    0.0900   -1.7600   -1.0300 H   0  0  0  0  0  0
   -2.4700   -1.3100   -0.3200 H   0  0  0  0  0  0
  1  2  1  0
  2  7  1  0
  2  3  2  0
  3  4  1  0
  4  5  2  0
  5  6  1  0
  5  7  1  0
  8  1  1  0
  9  1  1  0
 10  1  1  0
 11  3  1  0
 12  4  1  0
M  END

$$$$