COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.188   0.912  -1.063  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.309   2.193  -0.394  1.00  0.00           C  
HETATM    3  C   UNL     1       1.867   2.112   0.366  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.918  -0.429  -1.493  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.517  -1.045  -0.379  1.00  0.00           C  
HETATM    6  C   UNL     1       2.913   2.135  -0.538  1.00  0.00           C  
HETATM    7  C   UNL     1       3.774   1.060  -0.627  1.00  0.00           C  
HETATM    8  C   UNL     1       3.588  -0.049   0.196  1.00  0.00           C  
HETATM    9  C   UNL     1       2.532  -0.066   1.105  1.00  0.00           C  
HETATM   10  C   UNL     1       1.677   1.014   1.186  1.00  0.00           C  
HETATM   11  C   UNL     1       4.509  -1.208   0.104  1.00  0.00           C  
HETATM   12  C   UNL     1       6.258  -2.315  -0.725  1.00  0.00           C  
HETATM   13  C   UNL     1       4.379  -2.311   0.868  1.00  0.00           C  
HETATM   14  C   UNL     1       7.457  -2.546  -1.609  1.00  0.00           C  
HETATM   15  N   UNL     1       5.530  -1.252  -0.740  1.00  0.00           N  
HETATM   16  N   UNL     1      -4.187   0.616  -1.835  1.00  0.00           N  
HETATM   17  N   UNL     1      -2.316   1.977  -1.262  1.00  0.00           N  
HETATM   18  N   UNL     1      -0.463   3.225  -0.587  1.00  0.00           N  
HETATM   19  O   UNL     1      -1.162   1.458   0.563  1.00  0.00           O  
HETATM   20  O   UNL     1       0.203   3.444   1.780  1.00  0.00           O  
HETATM   21  O   UNL     1       1.495   4.614  -0.012  1.00  0.00           O  
HETATM   22  S   UNL     1      -3.104  -0.193   0.239  1.00  0.00           S  
HETATM   23  S   UNL     1       5.673  -3.425   0.434  1.00  0.00           S  
HETATM   24  S   UNL     1       0.775   3.491   0.480  1.00  0.00           S  
HETATM   25 BR   UNL     1      -5.324  -2.567   0.401  1.00  0.00          Br  
HETATM   26  H   UNL     1      -5.770  -0.759  -2.068  1.00  0.00           H  
HETATM   27  H   UNL     1       3.057   2.995  -1.175  1.00  0.00           H  
HETATM   28  H   UNL     1       4.590   1.078  -1.334  1.00  0.00           H  
HETATM   29  H   UNL     1       2.382  -0.923   1.746  1.00  0.00           H  
HETATM   30  H   UNL     1       0.858   1.003   1.890  1.00  0.00           H  
HETATM   31  H   UNL     1       3.617  -2.482   1.614  1.00  0.00           H  
HETATM   32  H   UNL     1       8.353  -2.176  -1.111  1.00  0.00           H  
HETATM   33  H   UNL     1       7.564  -3.614  -1.803  1.00  0.00           H  
HETATM   34  H   UNL     1       7.321  -2.017  -2.552  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.434   2.563  -2.026  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.580   3.812  -1.350  1.00  0.00           H  
CONECT    1   17   16   16   22                                       
CONECT    2   18   19   19   17                                       
CONECT    3   10   24    6    6                                       
CONECT    4   16    5    5   26                                       
CONECT    5   22    4    4   25                                       
CONECT    6    3    3    7   27                                       
CONECT    7    8    8    6   28                                       
CONECT    8    9   11    7    7                                       
CONECT    9   10   10    8   29                                       
CONECT   10    9    9    3   30                                       
CONECT   11   13   13    8   15                                       
CONECT   12   23   15   15   14                                       
CONECT   13   11   11   23   31                                       
CONECT   14   12   32   33   34                                       
CONECT   15   11   12   12                                            
CONECT   16    1    1    4                                            
CONECT   17    2    1   35                                            
CONECT   18   24    2   36                                            
CONECT   19    2    2                                                 
CONECT   20   24   24                                                 
CONECT   21   24   24                                                 
CONECT   22    1    5                                                 
CONECT   23   13   12                                                 
CONECT   24   21   21   20   20                                       
CONECT   24    3   18                                                 
CONECT   25    5                                                      
CONECT   26    4                                                      
CONECT   27    6                                                      
CONECT   28    7                                                      
CONECT   29    9                                                      
CONECT   30   10                                                      
CONECT   31   13                                                      
CONECT   32   14                                                      
CONECT   33   14                                                      
CONECT   34   14                                                      
CONECT   35   17                                                      
CONECT   36   18                                                      
MASTER        0    0    0    0    0    0    0    0   36    0   36    0
END
