COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.897   1.287   0.284  1.00  0.00           C  
HETATM    2  C   UNL     1       5.390   0.094  -0.192  1.00  0.00           C  
HETATM    3  O   UNL     1       0.919  -2.892  -1.186  1.00  0.00           O  
HETATM    4  C   UNL     1       4.026  -0.140  -0.169  1.00  0.00           C  
HETATM    5  C   UNL     1       3.170   0.821   0.331  1.00  0.00           C  
HETATM    6  O   UNL     1      -4.398  -0.296   0.985  1.00  0.00           O  
HETATM    7  C   UNL     1       3.678   2.017   0.808  1.00  0.00           C  
HETATM    8  O   UNL     1      -1.010  -3.613   0.699  1.00  0.00           O  
HETATM    9  C   UNL     1       5.040   2.247   0.790  1.00  0.00           C  
HETATM   10  N   UNL     1       1.803  -1.031  -0.355  1.00  0.00           N  
HETATM   11  C   UNL     1       1.755   0.310   0.237  1.00  0.00           C  
HETATM   12  C   UNL     1       3.214  -1.330  -0.616  1.00  0.00           C  
HETATM   13  C   UNL     1       0.751  -1.834  -0.610  1.00  0.00           C  
HETATM   14 BR   UNL     1      -2.931   2.000  -0.376  1.00  0.00          Br  
HETATM   15  C   UNL     1      -2.320   0.242  -0.042  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.152  -0.672   0.600  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.712  -1.963   0.848  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.442  -2.350   0.457  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.057  -0.132  -0.440  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.602  -1.431  -0.190  1.00  0.00           C  
HETATM   21  H   UNL     1       6.961   1.468   0.266  1.00  0.00           H  
HETATM   22  H   UNL     1       6.060  -0.658  -0.583  1.00  0.00           H  
HETATM   23  H   UNL     1      -5.079  -0.446   0.314  1.00  0.00           H  
HETATM   24  H   UNL     1       3.009   2.770   1.199  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.205  -4.239  -0.013  1.00  0.00           H  
HETATM   26  H   UNL     1       5.435   3.181   1.163  1.00  0.00           H  
HETATM   27  H   UNL     1       1.314   0.259   1.233  1.00  0.00           H  
HETATM   28  H   UNL     1       1.164   0.972  -0.396  1.00  0.00           H  
HETATM   29  H   UNL     1       3.365  -1.500  -1.682  1.00  0.00           H  
HETATM   30  H   UNL     1       3.515  -2.214  -0.054  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.361  -2.668   1.346  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.416   0.577  -0.942  1.00  0.00           H  
CONECT    1    9    2    2   21                                       
CONECT    2    1    1    4   22                                       
CONECT    3   13   13                                                 
CONECT    4    5    5    2   12                                       
CONECT    5    7   11    4    4                                       
CONECT    6   16   23                                                 
CONECT    7    9    9    5   24                                       
CONECT    8   18   25                                                 
CONECT    9    7    7    1   26                                       
CONECT   10   11   13   12                                            
CONECT   11    5   10   27   28                                       
CONECT   12    4   10   29   30                                       
CONECT   13    3    3   10   20                                       
CONECT   14   15                                                      
CONECT   15   16   16   19   14                                       
CONECT   16   17    6   15   15                                       
CONECT   17   18   18   16   31                                       
CONECT   18    8   17   17   20                                       
CONECT   19   20   20   15   32                                       
CONECT   20   18   13   19   19                                       
CONECT   21    1                                                      
CONECT   22    2                                                      
CONECT   23    6                                                      
CONECT   24    7                                                      
CONECT   25    8                                                      
CONECT   26    9                                                      
CONECT   27   11                                                      
CONECT   28   11                                                      
CONECT   29   12                                                      
CONECT   30   12                                                      
CONECT   31   17                                                      
CONECT   32   19                                                      
MASTER        0    0    0    0    0    0    0    0   32    0   32    0
END
