COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       0.764  -2.839   0.381  1.00  0.00           O  
HETATM    2  C   UNL     1      -1.789  -0.279  -2.513  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.504   0.559  -1.078  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.792   1.054  -0.941  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.137   1.788   0.181  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.199   2.032   1.170  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.912   1.544   1.039  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.563   0.809  -0.082  1.00  0.00           C  
HETATM    9  C   UNL     1       1.144   0.403   0.255  1.00  0.00           C  
HETATM   10  C   UNL     1       1.439  -0.827  -0.337  1.00  0.00           C  
HETATM   11  C   UNL     1       2.746  -1.158  -0.631  1.00  0.00           C  
HETATM   12  C   UNL     1       3.770  -0.270  -0.338  1.00  0.00           C  
HETATM   13  C   UNL     1       5.919   0.495  -0.993  1.00  0.00           C  
HETATM   14  N   UNL     1      -1.225  -4.032   1.119  1.00  0.00           N  
HETATM   15  S   UNL     1      -0.590  -2.559   0.707  1.00  0.00           S  
HETATM   16  O   UNL     1      -0.921  -1.716   1.803  1.00  0.00           O  
HETATM   17  C   UNL     1      -1.513  -2.067  -0.775  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.013  -0.704  -1.258  1.00  0.00           C  
HETATM   19  O   UNL     1      -3.175  -0.164  -2.181  1.00  0.00           O  
HETATM   20  F   UNL     1      -6.393   2.268   0.311  1.00  0.00           F  
HETATM   21  N   UNL     1      -1.254   0.314  -0.221  1.00  0.00           N  
HETATM   22  C   UNL     1      -0.255   0.755   0.568  1.00  0.00           C  
HETATM   23  O   UNL     1      -0.505   1.444   1.539  1.00  0.00           O  
HETATM   24  O   UNL     1       5.059  -0.586  -0.625  1.00  0.00           O  
HETATM   25  C   UNL     1       5.736   1.640  -0.030  1.00  0.00           C  
HETATM   26  O   UNL     1       6.667   2.373   0.229  1.00  0.00           O  
HETATM   27  N   UNL     1       4.531   1.846   0.544  1.00  0.00           N  
HETATM   28  C   UNL     1       3.481   0.962   0.254  1.00  0.00           C  
HETATM   29  C   UNL     1       2.176   1.297   0.555  1.00  0.00           C  
HETATM   30  H   UNL     1      -1.417   0.683  -2.865  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.662  -1.030  -3.293  1.00  0.00           H  
HETATM   32  H   UNL     1      -5.527   0.866  -1.709  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.472   2.605   2.043  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.180   1.735   1.810  1.00  0.00           H  
HETATM   35  H   UNL     1       0.644  -1.521  -0.565  1.00  0.00           H  
HETATM   36  H   UNL     1       2.971  -2.110  -1.088  1.00  0.00           H  
HETATM   37  H   UNL     1       6.956   0.160  -0.965  1.00  0.00           H  
HETATM   38  H   UNL     1       5.673   0.827  -2.002  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.982  -4.082   1.722  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.839  -4.845   0.757  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.363  -2.808  -1.559  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.575  -2.000  -0.536  1.00  0.00           H  
HETATM   43  H   UNL     1       0.052  -0.760  -1.483  1.00  0.00           H  
HETATM   44  H   UNL     1       4.393   2.593   1.147  1.00  0.00           H  
HETATM   45  H   UNL     1       1.952   2.250   1.012  1.00  0.00           H  
CONECT    1   15   15                                                 
CONECT    2   19   18   30   31                                       
CONECT    3    8    8    4   19                                       
CONECT    4    5    5    3   32                                       
CONECT    5    6   20    4    4                                       
CONECT    6    7    7    5   33                                       
CONECT    7    6    6    8   34                                       
CONECT    8    7   21    3    3                                       
CONECT    9   10   10   29   22                                       
CONECT   10   11    9    9   35                                       
CONECT   11   12   12   10   36                                       
CONECT   12   24   11   11   28                                       
CONECT   13   24   25   37   38                                       
CONECT   14   15   39   40                                            
CONECT   15    1    1   17   14                                       
CONECT   15   16   16                                                 
CONECT   16   15   15                                                 
CONECT   17   18   15   41   42                                       
CONECT   18   21    2   17   43                                       
CONECT   19    3    2                                                 
CONECT   20    5                                                      
CONECT   21   22    8   18                                            
CONECT   22    9   23   23   21                                       
CONECT   23   22   22                                                 
CONECT   24   13   12                                                 
CONECT   25   13   26   26   27                                       
CONECT   26   25   25                                                 
CONECT   27   25   28   44                                            
CONECT   28   12   27   29   29                                       
CONECT   29   28   28    9   45                                       
CONECT   30    2                                                      
CONECT   31    2                                                      
CONECT   32    4                                                      
CONECT   33    6                                                      
CONECT   34    7                                                      
CONECT   35   10                                                      
CONECT   36   11                                                      
CONECT   37   13                                                      
CONECT   38   13                                                      
CONECT   39   14                                                      
CONECT   40   14                                                      
CONECT   41   17                                                      
CONECT   42   17                                                      
CONECT   43   18                                                      
CONECT   44   27                                                      
CONECT   45   29                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
