COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       4.214   1.182  -1.899  1.00  0.00           O  
HETATM    2  C   UNL     1       3.916   0.038  -1.622  1.00  0.00           C  
HETATM    3  O   UNL     1       4.392  -0.981  -2.364  1.00  0.00           O  
HETATM    4  C   UNL     1       1.867  -0.988  -0.648  1.00  0.00           C  
HETATM    5  C   UNL     1       3.355   0.250   0.795  1.00  0.00           C  
HETATM    6  C   UNL     1       1.042  -1.241   0.435  1.00  0.00           C  
HETATM    7  N   UNL     1       4.587   1.048   0.988  1.00  0.00           N1+
HETATM    8  C   UNL     1       2.523  -0.003   1.866  1.00  0.00           C  
HETATM    9  O   UNL     1       4.805   1.582   2.060  1.00  0.00           O1-
HETATM   10  C   UNL     1       1.371  -0.748   1.691  1.00  0.00           C  
HETATM   11  O   UNL     1      -0.092  -1.973   0.269  1.00  0.00           O  
HETATM   12  C   UNL     1      -1.117  -1.088   0.152  1.00  0.00           C  
HETATM   13  O   UNL     1       5.383   1.171   0.073  1.00  0.00           O  
HETATM   14  C   UNL     1      -0.857   0.273   0.094  1.00  0.00           C  
HETATM   15  C   UNL     1       3.030  -0.237  -0.472  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.426  -1.546   0.085  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.900   1.170  -0.025  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.204   0.713  -0.086  1.00  0.00           C  
HETATM   19 CL   UNL     1      -2.756  -3.248   0.158  1.00  0.00          Cl  
HETATM   20  C   UNL     1      -3.467  -0.643  -0.028  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.340   1.695  -0.216  1.00  0.00           C  
HETATM   22  F   UNL     1      -4.605   1.926  -1.570  1.00  0.00           F  
HETATM   23  F   UNL     1      -5.481   1.171   0.400  1.00  0.00           F  
HETATM   24  F   UNL     1      -3.988   2.899   0.403  1.00  0.00           F  
HETATM   25  H   UNL     1       4.972  -0.801  -3.117  1.00  0.00           H  
HETATM   26  H   UNL     1       1.611  -1.371  -1.625  1.00  0.00           H  
HETATM   27  H   UNL     1       2.773   0.378   2.845  1.00  0.00           H  
HETATM   28  H   UNL     1       0.726  -0.948   2.533  1.00  0.00           H  
HETATM   29  H   UNL     1       0.161   0.631   0.142  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.698   2.230  -0.071  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.486  -0.997  -0.075  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3   15                                       
CONECT    3    2   25                                                 
CONECT    4    6   15   15   26                                       
CONECT    5    7    8    8   15                                       
CONECT    6    4   10   10   11                                       
CONECT    7    5    9   13   13                                       
CONECT    8    5    5   10   27                                       
CONECT    9    7                                                      
CONECT   10    6    6    8   28                                       
CONECT   11    6   12                                                 
CONECT   12   11   14   14   16                                       
CONECT   13    7    7                                                 
CONECT   14   12   12   17   29                                       
CONECT   15    2    4    4    5                                       
CONECT   16   12   19   20   20                                       
CONECT   17   14   18   18   30                                       
CONECT   18   17   17   20   21                                       
CONECT   19   16                                                      
CONECT   20   16   16   18   31                                       
CONECT   21   18   22   23   24                                       
CONECT   22   21                                                      
CONECT   23   21                                                      
CONECT   24   21                                                      
CONECT   25    3                                                      
CONECT   26    4                                                      
CONECT   27    8                                                      
CONECT   28   10                                                      
CONECT   29   14                                                      
CONECT   30   17                                                      
CONECT   31   20                                                      
MASTER        0    0    0    0    0    0    0    0   31    0   31    0
END
