COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.628   0.034   0.890  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.938   0.454   0.412  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.962  -0.110   1.217  1.00  0.00           C  
HETATM    4  F   UNL     1      -6.242   0.316   0.736  1.00  0.00           F  
HETATM    5  C   UNL     1      -4.578   1.163  -0.722  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.245   1.305  -1.055  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.265   0.745  -0.246  1.00  0.00           C  
HETATM    8  N   UNL     1      -0.913   0.898  -0.576  1.00  0.00           N  
HETATM    9  C   UNL     1      -0.063  -0.138  -0.431  1.00  0.00           C  
HETATM   10  S   UNL     1      -0.660  -1.679   0.018  1.00  0.00           S  
HETATM   11  N   UNL     1       1.257   0.039  -0.640  1.00  0.00           N  
HETATM   12  C   UNL     1       1.807   1.384  -0.858  1.00  0.00           C  
HETATM   13  C   UNL     1       2.945   1.619   0.139  1.00  0.00           C  
HETATM   14  O   UNL     1       3.573   2.872  -0.141  1.00  0.00           O  
HETATM   15  C   UNL     1       3.972   0.491   0.010  1.00  0.00           C  
HETATM   16  O   UNL     1       5.052   0.725   0.917  1.00  0.00           O  
HETATM   17  C   UNL     1       3.307  -0.846   0.343  1.00  0.00           C  
HETATM   18  O   UNL     1       2.778  -0.800   1.669  1.00  0.00           O  
HETATM   19  C   UNL     1       2.174  -1.109  -0.647  1.00  0.00           C  
HETATM   20  C   UNL     1       1.418  -2.375  -0.237  1.00  0.00           C  
HETATM   21  O   UNL     1       0.525  -2.756  -1.285  1.00  0.00           O  
HETATM   22  H   UNL     1      -1.867  -0.402   1.520  1.00  0.00           H  
HETATM   23  H   UNL     1      -4.244  -0.663   2.100  1.00  0.00           H  
HETATM   24  H   UNL     1      -5.340   1.602  -1.348  1.00  0.00           H  
HETATM   25  H   UNL     1      -2.965   1.859  -1.939  1.00  0.00           H  
HETATM   26  H   UNL     1      -0.588   1.749  -0.909  1.00  0.00           H  
HETATM   27  H   UNL     1       2.190   1.461  -1.876  1.00  0.00           H  
HETATM   28  H   UNL     1       1.025   2.128  -0.703  1.00  0.00           H  
HETATM   29  H   UNL     1       2.544   1.632   1.153  1.00  0.00           H  
HETATM   30  H   UNL     1       2.979   3.632  -0.080  1.00  0.00           H  
HETATM   31  H   UNL     1       4.354   0.463  -1.010  1.00  0.00           H  
HETATM   32  H   UNL     1       5.520   1.557   0.765  1.00  0.00           H  
HETATM   33  H   UNL     1       4.045  -1.646   0.273  1.00  0.00           H  
HETATM   34  H   UNL     1       3.442  -0.634   2.352  1.00  0.00           H  
HETATM   35  H   UNL     1       2.585  -1.235  -1.649  1.00  0.00           H  
HETATM   36  H   UNL     1       2.129  -3.180  -0.055  1.00  0.00           H  
HETATM   37  H   UNL     1       0.849  -2.179   0.672  1.00  0.00           H  
HETATM   38  H   UNL     1       0.017  -3.557  -1.097  1.00  0.00           H  
CONECT    1    3    3    7   22                                       
CONECT    2    3    4    5    5                                       
CONECT    3    1    1    2   23                                       
CONECT    4    2                                                      
CONECT    5    2    2    6   24                                       
CONECT    6    7    7    5   25                                       
CONECT    7    1    8    6    6                                       
CONECT    8    9    7   26                                            
CONECT    9   10   10   11    8                                       
CONECT   10    9    9                                                 
CONECT   11   19    9   12                                            
CONECT   12   11   13   27   28                                       
CONECT   13   15   12   14   29                                       
CONECT   14   13   30                                                 
CONECT   15   17   16   13   31                                       
CONECT   16   15   32                                                 
CONECT   17   18   19   15   33                                       
CONECT   18   17   34                                                 
CONECT   19   20   17   11   35                                       
CONECT   20   21   19   36   37                                       
CONECT   21   20   38                                                 
CONECT   22    1                                                      
CONECT   23    3                                                      
CONECT   24    5                                                      
CONECT   25    6                                                      
CONECT   26    8                                                      
CONECT   27   12                                                      
CONECT   28   12                                                      
CONECT   29   13                                                      
CONECT   30   14                                                      
CONECT   31   15                                                      
CONECT   32   16                                                      
CONECT   33   17                                                      
CONECT   34   18                                                      
CONECT   35   19                                                      
CONECT   36   20                                                      
CONECT   37   20                                                      
CONECT   38   21                                                      
MASTER        0    0    0    0    0    0    0    0   38    0   38    0
END
