@<TRIPOS>MOLECULE
REAL300018562202
  36   37    0    0    0
SMALL
NO_CHARGES
@<TRIPOS>ATOM
   1 C1             2.3706     1.3061    -0.1860 C.3     
   2 C2             1.3458     0.2321     0.0737 C.ar    
   3 C3             0.0087     0.5680     0.1848 C.ar    
   4 Br4           -0.5270     2.3732     0.0110 Br      
   5 C5            -0.9364    -0.4104     0.4218 C.ar    
   6 C6            -0.5427    -1.7446     0.5506 C.ar    
   7 C7            -1.5500    -2.7926     0.8043 C.2     
   8 O8            -2.7318    -2.4939     0.9024 O.co2   
   9 O9            -1.2030    -3.9599     0.9167 O.co2   
  10 C10            0.8075    -2.0828     0.4387 C.ar    
  11 C11            1.7478    -1.0926     0.2007 C.ar    
  12 N12            3.0999    -1.4261     0.0879 N.pl3   
  13 C13            3.5237    -2.8221     0.2212 C.3     
  14 C14            5.0194    -2.9106     0.0599 C.ar    
  15 C15            5.5602    -3.4115    -1.1062 C.ar    
  16 C16            6.9337    -3.4880    -1.2579 C.ar    
  17 C17            7.7716    -3.0738    -0.2379 C.ar    
  18 C18            7.2413    -2.5764     0.9350 C.ar    
  19 C19            5.8590    -2.4918     1.0910 C.ar    
  20 B20            5.2496    -1.9264     2.4228 Du      
  21 O21            4.1838    -2.6122     3.0633 O.3     
  22 O22            5.7641    -0.7291     2.9869 O.3     
  23 H23            2.5002     1.4323    -1.2609 H       
  24 H24            2.0319     2.2450     0.2518 H       
  25 H25            3.3210     1.0177     0.2631 H       
  26 H26           -1.9800    -0.1449     0.5032 H       
  27 H27            1.1181    -3.1125     0.5376 H       
  28 H28            3.7580    -0.7332    -0.0786 H       
  29 H29            3.2417    -3.1949     1.2059 H       
  30 H30            3.0390    -3.4239    -0.5476 H       
  31 H31            4.9106    -3.7404    -1.9039 H       
  32 H32            7.3529    -3.8766    -2.1742 H       
  33 H33            8.8426    -3.1395    -0.3600 H       
  34 H34            7.8963    -2.2537     1.7307 H       
  35 H35            3.9584    -3.4587     2.6537 H       
  36 H36            6.4873    -0.3348     2.4804 H       
@<TRIPOS>BOND
   1    1    2 1
   2    1   23 1
   3    1   24 1
   4    1   25 1
   5    2   11 ar
   6    2    3 ar
   7    3    4 1
   8    3    5 ar
   9    5    6 ar
  10    5   26 1
  11    6    7 1
  12    6   10 ar
  13    7    8 ar
  14    7    9 ar
  15   10   11 ar
  16   10   27 1
  17   11   12 1
  18   12   13 1
  19   12   28 1
  20   13   14 1
  21   13   29 1
  22   13   30 1
  23   14   19 ar
  24   14   15 ar
  25   15   16 ar
  26   15   31 1
  27   16   17 ar
  28   16   32 1
  29   17   18 ar
  30   17   33 1
  31   18   19 ar
  32   18   34 1
  33   19   20 1
  34   20   21 1
  35   20   22 1
  36   21   35 1
  37   22   36 1