COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      10.520  65.055  61.943  1.00  0.00           C  
HETATM    2  C   UNL     1      10.036  65.894  60.945  1.00  0.00           C  
HETATM    3  C   UNL     1       8.676  66.168  60.873  1.00  0.00           C  
HETATM    4 BR   UNL     1       7.992  67.314  59.525  1.00  0.00          Br  
HETATM    5  C   UNL     1       7.808  65.609  61.805  1.00  0.00           C  
HETATM    6  C   UNL     1       8.292  64.771  62.802  1.00  0.00           C  
HETATM    7  C   UNL     1       9.650  64.493  62.870  1.00  0.00           C  
HETATM    8  N   UNL     1      10.103  63.693  63.829  1.00  0.00           N  
HETATM    9  C   UNL     1      11.313  63.147  63.743  1.00  0.00           C  
HETATM   10  S   UNL     1      11.839  62.166  64.931  1.00  0.00           S  
HETATM   11  O   UNL     1      12.114  63.403  62.675  1.00  0.00           O  
HETATM   12  C   UNL     1      13.247  62.530  62.721  1.00  0.00           C  
HETATM   13  C   UNL     1      14.228  62.937  61.619  1.00  0.00           C  
HETATM   14  N   UNL     1      13.529  62.872  60.330  1.00  0.00           N  
HETATM   15  C   UNL     1      13.040  63.906  59.661  1.00  0.00           C  
HETATM   16  O   UNL     1      13.128  65.081  60.004  1.00  0.00           O  
HETATM   17  C   UNL     1      12.422  63.458  58.506  1.00  0.00           C  
HETATM   18  C   UNL     1      11.767  64.105  57.467  1.00  0.00           C  
HETATM   19  C   UNL     1      11.234  63.350  56.429  1.00  0.00           C  
HETATM   20  C   UNL     1      11.373  61.965  56.427  1.00  0.00           C  
HETATM   21  C   UNL     1      12.038  61.321  57.466  1.00  0.00           C  
HETATM   22  C   UNL     1      12.556  62.076  58.509  1.00  0.00           C  
HETATM   23  C   UNL     1      13.247  61.755  59.672  1.00  0.00           C  
HETATM   24  O   UNL     1      13.559  60.620  60.037  1.00  0.00           O  
HETATM   25  H   UNL     1      11.577  64.839  61.998  1.00  0.00           H  
HETATM   26  H   UNL     1      10.715  66.331  60.228  1.00  0.00           H  
HETATM   27  H   UNL     1       6.752  65.828  61.753  1.00  0.00           H  
HETATM   28  H   UNL     1       7.614  64.337  63.522  1.00  0.00           H  
HETATM   29  H   UNL     1       9.528  63.499  64.624  1.00  0.00           H  
HETATM   30  H   UNL     1      13.738  62.611  63.702  1.00  0.00           H  
HETATM   31  H   UNL     1      12.924  61.490  62.568  1.00  0.00           H  
HETATM   32  H   UNL     1      14.586  63.961  61.798  1.00  0.00           H  
HETATM   33  H   UNL     1      15.093  62.258  61.614  1.00  0.00           H  
HETATM   34  H   UNL     1      12.150  60.247  57.461  1.00  0.00           H  
HETATM   35  H   UNL     1      10.962  61.386  55.613  1.00  0.00           H  
HETATM   36  H   UNL     1      10.710  63.840  55.621  1.00  0.00           H  
HETATM   37  H   UNL     1      11.673  65.181  57.465  1.00  0.00           H  
CONECT    1    2    7    7   25                                       
CONECT    2    1    3    3   26                                       
CONECT    3    2    2    4    5                                       
CONECT    4    3                                                      
CONECT    5    3    6    6   27                                       
CONECT    6    5    5    7   28                                       
CONECT    7    1    1    6    8                                       
CONECT    8    7    9   29                                            
CONECT    9    8   10   10   11                                       
CONECT   10    9    9                                                 
CONECT   11    9   12                                                 
CONECT   12   11   13   30   31                                       
CONECT   13   12   14   32   33                                       
CONECT   14   13   23   15                                            
CONECT   15   14   17   16   16                                       
CONECT   16   15   15                                                 
CONECT   17   22   22   18   15                                       
CONECT   18   19   19   17   37                                       
CONECT   19   20   18   18   36                                       
CONECT   20   21   21   19   35                                       
CONECT   21   22   20   20   34                                       
CONECT   22   23   21   17   17                                       
CONECT   23   14   24   24   22                                       
CONECT   24   23   23                                                 
CONECT   25    1                                                      
CONECT   26    2                                                      
CONECT   27    5                                                      
CONECT   28    6                                                      
CONECT   29    8                                                      
CONECT   30   12                                                      
CONECT   31   12                                                      
CONECT   32   13                                                      
CONECT   33   13                                                      
CONECT   34   21                                                      
CONECT   35   20                                                      
CONECT   36   19                                                      
CONECT   37   18                                                      
MASTER        0    0    0    0    0    0    0    0   37    0   37    0
END
