TDT2MOL 
CC1(O)CCCCC1
 22 22  0  0  0  0              0      
    1.4500   -0.0100    1.1500 C   0  0  0  3  0  0
    0.9800    0.3300   -0.2300 C   0  0  0  0  0  0
    2.0200    0.8800   -0.9200 O   0  0  0  1  0  0
    0.5200   -0.9000   -0.9500 C   0  0  0  2  0  0
   -0.6800   -1.4900   -0.2700 C   0  0  0  2  0  0
   -1.7900   -0.4800   -0.2500 C   0  0  0  2  0  0
   -1.3400    0.7400    0.5000 C   0  0  0  2  0  0
   -0.1400    1.3300   -0.1800 C   0  0  0  2  0  0
    2.2900   -0.7200    1.0900 H   0  0  0  0  0  0
    1.8000    0.9100    1.6500 H   0  0  0  0  0  0
    0.6500   -0.4500    1.7500 H   0  0  0  0  0  0
    2.3000    1.6700   -0.4800 H   0  0  0  0  0  0
    0.2500   -0.6400   -1.9900 H   0  0  0  0  0  0
    1.3300   -1.6400   -0.9700 H   0  0  0  0  0  0
   -0.4300   -1.8000    0.7500 H   0  0  0  0  0  0
   -1.0100   -2.3900   -0.8300 H   0  0  0  0  0  0
   -2.0500   -0.2000   -1.2800 H   0  0  0  0  0  0
   -2.6700   -0.9200    0.2500 H   0  0  0  0  0  0
   -1.1000    0.4700    1.5400 H   0  0  0  0  0  0
   -2.1600    1.4800    0.5100 H   0  0  0  0  0  0
   -0.4200    1.6200   -1.2100 H   0  0  0  0  0  0
    0.1900    2.2200    0.3700 H   0  0  0  0  0  0
  1  2  1  0
  2  8  1  0
  2  3  1  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  9  1  1  0
 10  1  1  0
 11  1  1  0
 12  3  1  0
 13  4  1  0
 14  4  1  0
 15  5  1  0
 16  5  1  0
 17  6  1  0
 18  6  1  0
 19  7  1  0
 20  7  1  0
 21  8  1  0
 22  8  1  0
M  END

$$$$