COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.129   1.414   0.770  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.321   1.831   0.316  1.00  0.00           C  
HETATM    3  C   UNL     1       0.044   0.032   0.314  1.00  0.00           C  
HETATM    4  C   UNL     1       1.057  -0.917   0.458  1.00  0.00           C  
HETATM    5  C   UNL     1       0.911  -2.161  -0.114  1.00  0.00           C  
HETATM    6 BR   UNL     1       2.280  -3.451   0.078  1.00  0.00          Br  
HETATM    7  C   UNL     1      -0.236  -2.474  -0.832  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.245  -1.548  -0.983  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.118  -0.285  -0.413  1.00  0.00           C  
HETATM   10  N   UNL     1      -1.930   0.828  -0.387  1.00  0.00           N  
HETATM   11  C   UNL     1      -3.244   0.926  -1.027  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.296   0.369  -0.102  1.00  0.00           C  
HETATM   13  O   UNL     1      -3.978  -0.066   0.985  1.00  0.00           O  
HETATM   14  N   UNL     1      -5.589   0.356  -0.482  1.00  0.00           N  
HETATM   15  O   UNL     1      -6.577  -0.167   0.387  1.00  0.00           O  
HETATM   16  H   UNL     1      -1.739   2.813   0.483  1.00  0.00           H  
HETATM   17  H   UNL     1       1.951  -0.677   1.015  1.00  0.00           H  
HETATM   18  H   UNL     1      -0.339  -3.453  -1.276  1.00  0.00           H  
HETATM   19  H   UNL     1      -2.132  -1.801  -1.543  1.00  0.00           H  
HETATM   20  H   UNL     1      -3.466   1.971  -1.243  1.00  0.00           H  
HETATM   21  H   UNL     1      -3.240   0.356  -1.956  1.00  0.00           H  
HETATM   22  H   UNL     1      -5.842   0.704  -1.351  1.00  0.00           H  
HETATM   23  H   UNL     1      -7.474  -0.134   0.028  1.00  0.00           H  
HETATM   24  C   UNL     1       0.850   2.217   1.587  1.00  0.00           C  
HETATM   25  C   UNL     1       1.867   2.851   0.672  1.00  0.00           C  
HETATM   26  C   UNL     1       1.633   4.106   0.143  1.00  0.00           C  
HETATM   27  C   UNL     1       2.566   4.687  -0.696  1.00  0.00           C  
HETATM   28  C   UNL     1       3.733   4.013  -1.005  1.00  0.00           C  
HETATM   29  C   UNL     1       3.967   2.758  -0.475  1.00  0.00           C  
HETATM   30  C   UNL     1       3.036   2.178   0.367  1.00  0.00           C  
HETATM   31  H   UNL     1       0.317   2.996   2.131  1.00  0.00           H  
HETATM   32  H   UNL     1       1.357   1.561   2.294  1.00  0.00           H  
HETATM   33  H   UNL     1       0.722   4.633   0.385  1.00  0.00           H  
HETATM   34  H   UNL     1       2.383   5.668  -1.110  1.00  0.00           H  
HETATM   35  H   UNL     1       4.461   4.466  -1.661  1.00  0.00           H  
HETATM   36  H   UNL     1       4.878   2.231  -0.717  1.00  0.00           H  
HETATM   37  H   UNL     1       3.219   1.198   0.781  1.00  0.00           H  
CONECT    1    3    2    2   24                                       
CONECT    2    1    1   10   16                                       
CONECT    3    4    4    9    1                                       
CONECT    4    5    3    3   17                                       
CONECT    5    6    7    7    4                                       
CONECT    6    5                                                      
CONECT    7    5    5    8   18                                       
CONECT    8    7    9    9   19                                       
CONECT    9    8    8    3   10                                       
CONECT   10    9    2   11                                            
CONECT   11   10   12   20   21                                       
CONECT   12   14   11   13   13                                       
CONECT   13   12   12                                                 
CONECT   14   15   12   22                                            
CONECT   15   14   23                                                 
CONECT   16    2                                                      
CONECT   17    4                                                      
CONECT   18    7                                                      
CONECT   19    8                                                      
CONECT   20   11                                                      
CONECT   21   11                                                      
CONECT   22   14                                                      
CONECT   23   15                                                      
CONECT   24    1   25   31   32                                       
CONECT   25   24   26   30   30                                       
CONECT   26   25   27   27   33                                       
CONECT   27   26   26   28   34                                       
CONECT   28   27   29   29   35                                       
CONECT   29   28   28   30   36                                       
CONECT   30   29   25   25   37                                       
CONECT   31   24                                                      
CONECT   32   24                                                      
CONECT   33   26                                                      
CONECT   34   27                                                      
CONECT   35   28                                                      
CONECT   36   29                                                      
CONECT   37   30                                                      
MASTER        0    0    0    0    0    0    0    0   37    0   37    0
END
