COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       7.281  -0.783  -0.923  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.454   0.373   0.309  1.00  0.00           C  
HETATM    3  C   UNL     1       8.637  -1.771   0.656  1.00  0.00           C  
HETATM    4  C   UNL     1       2.137   1.202  -0.208  1.00  0.00           C  
HETATM    5  C   UNL     1       5.929   1.277  -0.458  1.00  0.00           C  
HETATM    6  C   UNL     1       3.520   1.645  -0.484  1.00  0.00           C  
HETATM    7  C   UNL     1       1.902  -0.050   0.363  1.00  0.00           C  
HETATM    8  C   UNL     1       0.609  -0.457   0.618  1.00  0.00           C  
HETATM    9  C   UNL     1       6.895   0.201  -0.033  1.00  0.00           C  
HETATM   10  C   UNL     1       8.292  -0.823   1.602  1.00  0.00           C  
HETATM   11  C   UNL     1       7.406   0.186   1.256  1.00  0.00           C  
HETATM   12  N   UNL     1       8.126  -1.728  -0.559  1.00  0.00           N  
HETATM   13  N   UNL     1       4.558   0.839  -0.184  1.00  0.00           N  
HETATM   14  O   UNL     1       3.722   2.735  -0.982  1.00  0.00           O  
HETATM   15  C   UNL     1      -0.228   1.615  -0.258  1.00  0.00           C  
HETATM   16  C   UNL     1       1.060   2.034  -0.518  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.865  -0.081   0.584  1.00  0.00           C  
HETATM   18  N   UNL     1      -2.386  -0.791  -0.587  1.00  0.00           N  
HETATM   19  S   UNL     1      -3.752  -1.717  -0.452  1.00  0.00           S  
HETATM   20  O   UNL     1      -4.014  -2.237  -1.749  1.00  0.00           O  
HETATM   21  O   UNL     1      -3.568  -2.540   0.692  1.00  0.00           O  
HETATM   22  C   UNL     1      -5.085  -0.629  -0.074  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.391  -0.343   1.243  1.00  0.00           C  
HETATM   24  C   UNL     1      -6.436   0.511   1.541  1.00  0.00           C  
HETATM   25  C   UNL     1      -7.177   1.079   0.520  1.00  0.00           C  
HETATM   26  C   UNL     1      -6.870   0.792  -0.800  1.00  0.00           C  
HETATM   27  C   UNL     1      -5.821  -0.058  -1.095  1.00  0.00           C  
HETATM   28  F   UNL     1      -8.199   1.914   0.809  1.00  0.00           F  
HETATM   29  H   UNL     1       6.884  -0.780  -1.927  1.00  0.00           H  
HETATM   30  H   UNL     1       9.326  -2.560   0.918  1.00  0.00           H  
HETATM   31  H   UNL     1       6.136   2.191   0.099  1.00  0.00           H  
HETATM   32  H   UNL     1       6.044   1.468  -1.525  1.00  0.00           H  
HETATM   33  H   UNL     1       2.731  -0.698   0.605  1.00  0.00           H  
HETATM   34  H   UNL     1       0.426  -1.425   1.059  1.00  0.00           H  
HETATM   35  H   UNL     1       8.706  -0.869   2.598  1.00  0.00           H  
HETATM   36  H   UNL     1       7.122   0.942   1.972  1.00  0.00           H  
HETATM   37  H   UNL     1       4.398  -0.032   0.213  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.063   2.258  -0.497  1.00  0.00           H  
HETATM   39  H   UNL     1       1.235   3.004  -0.960  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.870  -0.748   1.446  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.491   0.786   0.791  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.931  -0.718  -1.441  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.813  -0.787   2.040  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.675   0.734   2.571  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.448   1.235  -1.598  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.579  -0.278  -2.124  1.00  0.00           H  
CONECT    1    9    9   12   29                                       
CONECT    2    8   17   15   15                                       
CONECT    3   12   12   10   30                                       
CONECT    4    7    6   16   16                                       
CONECT    5   13    9   31   32                                       
CONECT    6   14   14    4   13                                       
CONECT    7    8    8    4   33                                       
CONECT    8    7    7    2   34                                       
CONECT    9    5    1    1   11                                       
CONECT   10   11   11    3   35                                       
CONECT   11    9   10   10   36                                       
CONECT   12    1    3    3                                            
CONECT   13    6    5   37                                            
CONECT   14    6    6                                                 
CONECT   15    2    2   16   38                                       
CONECT   16    4    4   15   39                                       
CONECT   17    2   18   40   41                                       
CONECT   18   17   19   42                                            
CONECT   19   21   21   18   22                                       
CONECT   19   20   20                                                 
CONECT   20   19   19                                                 
CONECT   21   19   19                                                 
CONECT   22   23   19   27   27                                       
CONECT   23   24   24   22   43                                       
CONECT   24   23   23   25   44                                       
CONECT   25   24   28   26   26                                       
CONECT   26   25   25   27   45                                       
CONECT   27   22   22   26   46                                       
CONECT   28   25                                                      
CONECT   29    1                                                      
CONECT   30    3                                                      
CONECT   31    5                                                      
CONECT   32    5                                                      
CONECT   33    7                                                      
CONECT   34    8                                                      
CONECT   35   10                                                      
CONECT   36   11                                                      
CONECT   37   13                                                      
CONECT   38   15                                                      
CONECT   39   16                                                      
CONECT   40   17                                                      
CONECT   41   17                                                      
CONECT   42   18                                                      
CONECT   43   23                                                      
CONECT   44   24                                                      
CONECT   45   26                                                      
CONECT   46   27                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
