COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.137   2.005   0.266  1.00  0.00           C  
HETATM    2  C   UNL     1       5.336   0.637   0.140  1.00  0.00           C  
HETATM    3  C   UNL     1       4.250  -0.215  -0.023  1.00  0.00           C  
HETATM    4  C   UNL     1       2.970   0.296  -0.061  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.356   0.573  -0.547  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.188   0.566  -1.651  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.095  -0.462  -1.827  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.171  -1.484  -0.900  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.338  -1.478   0.205  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.427  -0.452   0.378  1.00  0.00           C  
HETATM   11  C   UNL     1       3.860   2.524   0.235  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.661   2.413   0.963  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.368   1.694  -0.355  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.970   1.131  -0.321  1.00  0.00           C  
HETATM   15  C   UNL     1       1.399   2.223   0.032  1.00  0.00           C  
HETATM   16  C   UNL     1       2.766   1.673   0.066  1.00  0.00           C  
HETATM   17  N   UNL     1      -2.775   3.578   1.093  1.00  0.00           N  
HETATM   18  N   UNL     1      -0.916   1.954  -0.157  1.00  0.00           N  
HETATM   19  N   UNL     1       0.383   1.431  -0.125  1.00  0.00           N  
HETATM   20  O   UNL     1      -1.794  -0.064  -0.440  1.00  0.00           O  
HETATM   21  O   UNL     1       6.595   0.129   0.176  1.00  0.00           O  
HETATM   22 BR   UNL     1       4.528  -2.078  -0.195  1.00  0.00          Br  
HETATM   23 CL   UNL     1      -5.433  -2.761   1.370  1.00  0.00          Cl  
HETATM   24  H   UNL     1       5.984   2.663   0.393  1.00  0.00           H  
HETATM   25  H   UNL     1       2.127  -0.367  -0.189  1.00  0.00           H  
HETATM   26  H   UNL     1      -5.130   1.365  -2.375  1.00  0.00           H  
HETATM   27  H   UNL     1      -6.746  -0.467  -2.690  1.00  0.00           H  
HETATM   28  H   UNL     1      -6.880  -2.287  -1.038  1.00  0.00           H  
HETATM   29  H   UNL     1      -3.777  -0.447   1.240  1.00  0.00           H  
HETATM   30  H   UNL     1       3.707   3.589   0.334  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.699   2.743   0.974  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.488   1.730   1.795  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.454   2.400  -1.181  1.00  0.00           H  
HETATM   34  H   UNL     1       1.242   3.287   0.138  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.870   4.194   0.300  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.949   4.070   1.956  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.056   2.909  -0.062  1.00  0.00           H  
HETATM   38  H   UNL     1       6.899  -0.107   1.063  1.00  0.00           H  
CONECT    1   11    2    2   24                                       
CONECT    2    3    1    1   21                                       
CONECT    3    4    4    2   22                                       
CONECT    4   16    3    3   25                                       
CONECT    5    6    6   10   13                                       
CONECT    6    7    5    5   26                                       
CONECT    7    8    8    6   27                                       
CONECT    8    7    7    9   28                                       
CONECT    9    8   23   10   10                                       
CONECT   10    9    9    5   29                                       
CONECT   11   16   16    1   30                                       
CONECT   12   13   17   31   32                                       
CONECT   13    5   12   14   33                                       
CONECT   14   13   20   20   18                                       
CONECT   15   19   19   16   34                                       
CONECT   16   15   11   11    4                                       
CONECT   17   12   35   36                                            
CONECT   18   14   19   37                                            
CONECT   19   18   15   15                                            
CONECT   20   14   14                                                 
CONECT   21    2   38                                                 
CONECT   22    3                                                      
CONECT   23    9                                                      
CONECT   24    1                                                      
CONECT   25    4                                                      
CONECT   26    6                                                      
CONECT   27    7                                                      
CONECT   28    8                                                      
CONECT   29   10                                                      
CONECT   30   11                                                      
CONECT   31   12                                                      
CONECT   32   12                                                      
CONECT   33   13                                                      
CONECT   34   15                                                      
CONECT   35   17                                                      
CONECT   36   17                                                      
CONECT   37   18                                                      
CONECT   38   21                                                      
MASTER        0    0    0    0    0    0    0    0   38    0   38    0
END
