COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.647   0.618  -0.299  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.079   0.384  -1.834  1.00  0.00           C  
HETATM    3  C   UNL     1      -6.303   0.323  -0.808  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.490   0.436   1.579  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.915   0.574   0.700  1.00  0.00           C  
HETATM    6  C   UNL     1       2.038   0.312  -0.056  1.00  0.00           C  
HETATM    7  C   UNL     1       3.406   0.144   0.068  1.00  0.00           C  
HETATM    8  C   UNL     1       3.931  -1.140   0.169  1.00  0.00           C  
HETATM    9  CA  UNL     1       1.828  -2.084   0.040  1.00  0.00           C  
HETATM   10  C   UNL     1       0.993  -3.294   0.019  1.00  0.00           C  
HETATM   11  C   UNL     1       1.229  -0.821  -0.072  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.147   0.549  -0.424  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.728   0.461  -1.688  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.904   0.401  -0.697  1.00  0.00           C  
HETATM   15  C   UNL     1      -7.070   0.342   0.316  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.139   0.513   1.726  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.314   0.497   0.588  1.00  0.00           C  
HETATM   18  N   UNL     1       3.150  -2.195   0.146  1.00  0.00           N  
HETATM   19  O   UNL     1       1.508  -4.389   0.098  1.00  0.00           O  
HETATM   20  O   UNL     1      -0.117  -0.705  -0.191  1.00  0.00           O  
HETATM   21 BR   UNL     1       4.553   1.647   0.102  1.00  0.00          Br  
HETATM   22  H   UNL     1      -0.231   1.105  -1.181  1.00  0.00           H  
HETATM   23  H   UNL     1      -0.382   1.189   0.590  1.00  0.00           H  
HETATM   24  H   UNL     1      -4.515   0.316  -2.820  1.00  0.00           H  
HETATM   25  H   UNL     1      -6.767   0.250  -1.781  1.00  0.00           H  
HETATM   26  H   UNL     1      -7.121   0.449   2.455  1.00  0.00           H  
HETATM   27  H   UNL     1      -2.451   0.642   1.673  1.00  0.00           H  
HETATM   28  H   UNL     1       1.608   1.300  -0.136  1.00  0.00           H  
HETATM   29  H   UNL     1       4.998  -1.271   0.266  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.080  -3.208  -0.068  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.097   0.452  -2.564  1.00  0.00           H  
HETATM   32  H   UNL     1      -8.145   0.282   0.227  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.703   0.587   2.711  1.00  0.00           H  
CONECT    1   12   20   22   23                                       
CONECT    2   14   13   13   24                                       
CONECT    3   15   15   14   25                                       
CONECT    4   15   16   16   26                                       
CONECT    5   17   12   12   27                                       
CONECT    6   11   11    7   28                                       
CONECT    7    6   21    8    8                                       
CONECT    8    7    7   18   29                                       
CONECT    9   11   10   18   18                                       
CONECT   10    9   19   19   30                                       
CONECT   11   20    6    6    9                                       
CONECT   12   13    5    5    1                                       
CONECT   13    2    2   12   31                                       
CONECT   14    3    2   17   17                                       
CONECT   15    3    3    4   32                                       
CONECT   16    4    4   17   33                                       
CONECT   17   14   14   16    5                                       
CONECT   18    9    9    8                                            
CONECT   19   10   10                                                 
CONECT   20    1   11                                                 
CONECT   21    7                                                      
CONECT   22    1                                                      
CONECT   23    1                                                      
CONECT   24    2                                                      
CONECT   25    3                                                      
CONECT   26    4                                                      
CONECT   27    5                                                      
CONECT   28    6                                                      
CONECT   29    8                                                      
CONECT   30   10                                                      
CONECT   31   13                                                      
CONECT   32   15                                                      
CONECT   33   16                                                      
MASTER        0    0    0    0    0    0    0    0   33    0   33    0
END
