COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.921   2.785   1.540  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.072   0.555   1.792  1.00  0.00           C  
HETATM    3  C   UNL     1       2.452   0.734   0.123  1.00  0.00           C  
HETATM    4  C   UNL     1       4.091   1.537   1.538  1.00  0.00           C  
HETATM    5  C   UNL     1       4.371  -0.596   0.714  1.00  0.00           C  
HETATM    6  C   UNL     1       3.162  -0.463   0.011  1.00  0.00           C  
HETATM    7  C   UNL     1       4.033  -2.445  -0.367  1.00  0.00           C  
HETATM    8  C   UNL     1       1.295   1.457  -1.913  1.00  0.00           C  
HETATM    9  C   UNL     1       0.335   2.654  -1.990  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.134   0.989  -0.302  1.00  0.00           C  
HETATM   11  C   UNL     1       0.075   0.576   0.079  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.315   0.563   0.468  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.843  -0.693   0.526  1.00  0.00           C  
HETATM   14  N   UNL     1       2.951   1.700   0.893  1.00  0.00           N  
HETATM   15  N   UNL     1       4.794   0.428   1.463  1.00  0.00           N  
HETATM   16  N   UNL     1       2.979  -1.651  -0.663  1.00  0.00           N  
HETATM   17  N   UNL     1       4.849  -1.824   0.440  1.00  0.00           N  
HETATM   18  N   UNL     1       1.258   0.915  -0.554  1.00  0.00           N  
HETATM   19  N   UNL     1      -3.909  -0.656   1.334  1.00  0.00           N  
HETATM   20  N   UNL     1      -3.100   1.355   1.280  1.00  0.00           N  
HETATM   21  S   UNL     1      -1.350   2.034  -1.705  1.00  0.00           S  
HETATM   22 BR   UNL     1      -2.184  -2.218  -0.377  1.00  0.00          Br  
HETATM   23  H   UNL     1      -3.481   3.361   0.803  1.00  0.00           H  
HETATM   24  H   UNL     1      -3.285   3.021   2.539  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.863   3.037   1.469  1.00  0.00           H  
HETATM   26  H   UNL     1      -4.855   0.872   2.466  1.00  0.00           H  
HETATM   27  H   UNL     1       4.460   2.345   2.152  1.00  0.00           H  
HETATM   28  H   UNL     1       4.179  -3.446  -0.744  1.00  0.00           H  
HETATM   29  H   UNL     1       0.981   0.690  -2.621  1.00  0.00           H  
HETATM   30  H   UNL     1       2.308   1.781  -2.150  1.00  0.00           H  
HETATM   31  H   UNL     1       0.594   3.385  -1.223  1.00  0.00           H  
HETATM   32  H   UNL     1       0.397   3.115  -2.976  1.00  0.00           H  
HETATM   33  H   UNL     1       0.135  -0.069   0.943  1.00  0.00           H  
HETATM   34  H   UNL     1       2.233  -1.876  -1.240  1.00  0.00           H  
CONECT    1   20   23   24   25                                       
CONECT    2   20   19   19   26                                       
CONECT    3   14   18    6    6                                       
CONECT    4   14   14   15   27                                       
CONECT    5   15   15    6   17                                       
CONECT    6    3    3    5   16                                       
CONECT    7   17   17   16   28                                       
CONECT    8    9   18   29   30                                       
CONECT    9    8   21   31   32                                       
CONECT   10   21   11   11   12                                       
CONECT   11   18   10   10   33                                       
CONECT   12   10   20   13   13                                       
CONECT   13   12   12   19   22                                       
CONECT   14    4    4    3                                            
CONECT   15    4    5    5                                            
CONECT   16    6    7   34                                            
CONECT   17    5    7    7                                            
CONECT   18    8    3   11                                            
CONECT   19    2    2   13                                            
CONECT   20    1   12    2                                            
CONECT   21    9   10                                                 
CONECT   22   13                                                      
CONECT   23    1                                                      
CONECT   24    1                                                      
CONECT   25    1                                                      
CONECT   26    2                                                      
CONECT   27    4                                                      
CONECT   28    7                                                      
CONECT   29    8                                                      
CONECT   30    8                                                      
CONECT   31    9                                                      
CONECT   32    9                                                      
CONECT   33   11                                                      
CONECT   34   16                                                      
MASTER        0    0    0    0    0    0    0    0   34    0   34    0
END
