COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.562   0.044   0.103  1.00  0.00           C  
HETATM    2  C   UNL     1       3.349  -0.641   0.034  1.00  0.00           C  
HETATM    3  C   UNL     1       3.342  -2.037   0.004  1.00  0.00           C  
HETATM    4  C   UNL     1       0.870  -0.459  -0.072  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.237   0.476  -0.101  1.00  0.00           C  
HETATM    6  C   UNL     1       0.198   1.803  -0.052  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.771   2.837  -0.073  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.119   2.497  -0.141  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.634   0.235  -0.168  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.538  -1.327  -0.287  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.778  -2.693  -0.937  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.281  -2.985  -0.951  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.819  -2.939   0.481  1.00  0.00           C  
HETATM   14  O   UNL     1       0.822   4.536   0.035  1.00  0.00           O  
HETATM   15  C   UNL     1      -0.359   4.249  -0.024  1.00  0.00           C  
HETATM   16  N   UNL     1      -1.289   5.224  -0.045  1.00  0.00           N  
HETATM   17  S   UNL     1       1.952   1.857   0.026  1.00  0.00           S  
HETATM   18  C   UNL     1       2.075   0.108  -0.006  1.00  0.00           C  
HETATM   19  C   UNL     1       4.536  -2.730   0.042  1.00  0.00           C  
HETATM   20  F   UNL     1       4.533  -4.081   0.013  1.00  0.00           F  
HETATM   21  C   UNL     1       5.738  -2.043   0.111  1.00  0.00           C  
HETATM   22  C   UNL     1       5.749  -0.660   0.135  1.00  0.00           C  
HETATM   23  N   UNL     1      -2.496   1.234  -0.185  1.00  0.00           N  
HETATM   24  N   UNL     1      -2.098  -1.066  -0.217  1.00  0.00           N  
HETATM   25  C   UNL     1      -4.126  -1.328   1.126  1.00  0.00           C  
HETATM   26  N   UNL     1      -5.565  -1.612   1.058  1.00  0.00           N  
HETATM   27  H   UNL     1       4.573   1.123   0.126  1.00  0.00           H  
HETATM   28  H   UNL     1       2.406  -2.573  -0.049  1.00  0.00           H  
HETATM   29  H   UNL     1       0.729  -1.529  -0.097  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.865   3.277  -0.157  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.020  -0.552  -0.882  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.400  -2.682  -1.959  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.262  -3.464  -0.365  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.792  -2.235  -1.556  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.456  -3.974  -1.374  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.892  -3.132   0.473  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.318  -3.698   1.082  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.230   4.995  -0.092  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.017   6.154  -0.012  1.00  0.00           H  
HETATM   40  H   UNL     1       6.669  -2.589   0.141  1.00  0.00           H  
HETATM   41  H   UNL     1       6.688  -0.130   0.188  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.471  -1.806  -0.205  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.633  -2.095   1.724  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.969  -0.352   1.585  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.051  -0.895   0.541  1.00  0.00           H  
CONECT    1   22    2    2   27                                       
CONECT    2    1    1    3   18                                       
CONECT    3   19   19    2   28                                       
CONECT    4   18   18    5   29                                       
CONECT    5    4    9    9    6                                       
CONECT    6    5   17    7    7                                       
CONECT    7    6    6    8   15                                       
CONECT    8   23   23    7   30                                       
CONECT    9   24    5    5   23                                       
CONECT   10   25   11   24   31                                       
CONECT   11   12   10   32   33                                       
CONECT   12   13   11   34   35                                       
CONECT   13   26   12   36   37                                       
CONECT   14   15   15                                                 
CONECT   15    7   14   14   16                                       
CONECT   16   15   38   39                                            
CONECT   17   18    6                                                 
CONECT   18    2    4    4   17                                       
CONECT   19   21   20    3    3                                       
CONECT   20   19                                                      
CONECT   21   22   22   19   40                                       
CONECT   22   21   21    1   41                                       
CONECT   23    9    8    8                                            
CONECT   24   10    9   42                                            
CONECT   25   26   10   43   44                                       
CONECT   26   13   25   45                                            
CONECT   27    1                                                      
CONECT   28    3                                                      
CONECT   29    4                                                      
CONECT   30    8                                                      
CONECT   31   10                                                      
CONECT   32   11                                                      
CONECT   33   11                                                      
CONECT   34   12                                                      
CONECT   35   12                                                      
CONECT   36   13                                                      
CONECT   37   13                                                      
CONECT   38   16                                                      
CONECT   39   16                                                      
CONECT   40   21                                                      
CONECT   41   22                                                      
CONECT   42   24                                                      
CONECT   43   25                                                      
CONECT   44   25                                                      
CONECT   45   26                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
