COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.313   1.563   0.501  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.854   2.283  -0.124  1.00  0.00           C  
HETATM    3  C   UNL     1       6.762  -0.598  -0.222  1.00  0.00           C  
HETATM    4  O   UNL     1      -1.795   1.651  -0.556  1.00  0.00           O  
HETATM    5  N   UNL     1      -0.853   3.628  -0.202  1.00  0.00           N  
HETATM    6  N   UNL     1       7.010  -0.404   1.213  1.00  0.00           N  
HETATM    7  C   UNL     1      -2.052  -0.931   0.492  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.628  -1.567  -0.592  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.991  -1.475  -0.803  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.779  -0.747   0.072  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.201  -0.111   1.157  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.838  -0.203   1.366  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.619  -2.168  -1.985  1.00  0.00           C  
HETATM   14  C   UNL     1       1.112  -0.039  -1.297  1.00  0.00           C  
HETATM   15  C   UNL     1       2.586  -0.184  -1.016  1.00  0.00           C  
HETATM   16  C   UNL     1       3.412   0.922  -1.072  1.00  0.00           C  
HETATM   17  C   UNL     1       4.764   0.788  -0.814  1.00  0.00           C  
HETATM   18  C   UNL     1       5.289  -0.452  -0.502  1.00  0.00           C  
HETATM   19  C   UNL     1       4.462  -1.558  -0.446  1.00  0.00           C  
HETATM   20  C   UNL     1       3.109  -1.423  -0.698  1.00  0.00           C  
HETATM   21  C   UNL     1       0.118   1.495   2.017  1.00  0.00           C  
HETATM   22  N   UNL     1       0.397   0.205  -0.042  1.00  0.00           N  
HETATM   23  O   UNL     1      -1.950   4.304  -0.790  1.00  0.00           O  
HETATM   24  S   UNL     1      -0.315  -1.054   0.763  1.00  0.00           S  
HETATM   25  O   UNL     1      -0.108  -0.813   2.148  1.00  0.00           O  
HETATM   26  O   UNL     1       0.110  -2.241   0.108  1.00  0.00           O  
HETATM   27  F   UNL     1      -6.111  -0.657  -0.134  1.00  0.00           F  
HETATM   28  H   UNL     1       1.234   2.102   0.277  1.00  0.00           H  
HETATM   29  H   UNL     1       7.316   0.150  -0.790  1.00  0.00           H  
HETATM   30  H   UNL     1       7.091  -1.594  -0.516  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.101   4.134   0.143  1.00  0.00           H  
HETATM   32  H   UNL     1       7.991  -0.497   1.427  1.00  0.00           H  
HETATM   33  H   UNL     1       6.655   0.488   1.524  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.013  -2.135  -1.275  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.814   0.458   1.840  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.386   0.293   2.212  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.915  -3.178  -1.699  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.497  -1.610  -2.309  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.899  -2.218  -2.802  1.00  0.00           H  
HETATM   40  H   UNL     1       0.953   0.800  -1.975  1.00  0.00           H  
HETATM   41  H   UNL     1       0.738  -0.953  -1.757  1.00  0.00           H  
HETATM   42  H   UNL     1       3.002   1.891  -1.316  1.00  0.00           H  
HETATM   43  H   UNL     1       5.410   1.653  -0.858  1.00  0.00           H  
HETATM   44  H   UNL     1       4.872  -2.527  -0.202  1.00  0.00           H  
HETATM   45  H   UNL     1       2.463  -2.287  -0.651  1.00  0.00           H  
HETATM   46  H   UNL     1       0.893   0.867   2.455  1.00  0.00           H  
HETATM   47  H   UNL     1       0.184   2.499   2.437  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.861   1.072   2.239  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.859   5.267  -0.800  1.00  0.00           H  
CONECT    1   21   22    2   28                                       
CONECT    2    1    5    4    4                                       
CONECT    3   18    6   29   30                                       
CONECT    4    2    2                                                 
CONECT    5    2   23   31                                            
CONECT    6    3   32   33                                            
CONECT    7   24    8    8   12                                       
CONECT    8    7    7    9   34                                       
CONECT    9    8   13   10   10                                       
CONECT   10    9    9   11   27                                       
CONECT   11   12   12   10   35                                       
CONECT   12    7   11   11   36                                       
CONECT   13    9   37   38   39                                       
CONECT   14   15   22   40   41                                       
CONECT   15   16   14   20   20                                       
CONECT   16   17   17   15   42                                       
CONECT   17   16   16   18   43                                       
CONECT   18   17    3   19   19                                       
CONECT   19   18   18   20   44                                       
CONECT   20   15   15   19   45                                       
CONECT   21    1   46   47   48                                       
CONECT   22   24    1   14                                            
CONECT   23    5   49                                                 
CONECT   24   25   25   26   26                                       
CONECT   24   22    7                                                 
CONECT   25   24   24                                                 
CONECT   26   24   24                                                 
CONECT   27   10                                                      
CONECT   28    1                                                      
CONECT   29    3                                                      
CONECT   30    3                                                      
CONECT   31    5                                                      
CONECT   32    6                                                      
CONECT   33    6                                                      
CONECT   34    8                                                      
CONECT   35   11                                                      
CONECT   36   12                                                      
CONECT   37   13                                                      
CONECT   38   13                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   14                                                      
CONECT   42   16                                                      
CONECT   43   17                                                      
CONECT   44   19                                                      
CONECT   45   20                                                      
CONECT   46   21                                                      
CONECT   47   21                                                      
CONECT   48   21                                                      
CONECT   49   23                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
