TDT2MOL 
OCC(=O)c1ccccc1
 18 18  0  0  0  0              0      
   -2.6600   -0.2200   -1.2500 O   0  0  0  1  0  0
   -2.4900    0.5400   -0.1500 C   0  0  0  2  0  0
   -1.4800   -0.1000    0.7500 C   0  0  0  0  0  0
   -1.8500   -0.6500    1.8100 O   0  0  0  0  0  0
   -0.0300   -0.0800    0.3900 C   0  0  0  0  0  0
    0.3900    0.5300   -0.8000 C   0  0  0  1  0  0
    1.7500    0.5500   -1.1400 C   0  0  0  1  0  0
    2.6900   -0.0500   -0.2900 C   0  0  0  1  0  0
    2.2700   -0.6600    0.9000 C   0  0  0  1  0  0
    0.9100   -0.6800    1.2400 C   0  0  0  1  0  0
   -2.9800   -1.0800   -1.0000 H   0  0  0  0  0  0
   -3.4500    0.6400    0.3800 H   0  0  0  0  0  0
   -2.1400    1.5400   -0.4500 H   0  0  0  0  0  0
   -0.3500    1.0000   -1.4700 H   0  0  0  0  0  0
    2.0800    1.0300   -2.0700 H   0  0  0  0  0  0
    3.7600   -0.0400   -0.5600 H   0  0  0  0  0  0
    3.0100   -1.1300    1.5700 H   0  0  0  0  0  0
    0.5800   -1.1600    2.1700 H   0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  3  5  1  0
  5 10  1  0
  5  6  2  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  2  0
 11  1  1  0
 12  2  1  0
 13  2  1  0
 14  6  1  0
 15  7  1  0
 16  8  1  0
 17  9  1  0
 18 10  1  0
M  END

$$$$