COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  S   UNL     1      -8.077  -1.158  -0.615  1.00  0.00           S  
HETATM    2  N   UNL     1      -7.718  -2.392  -1.659  1.00  0.00           N  
HETATM    3  O   UNL     1      -9.005  -0.320  -1.289  1.00  0.00           O  
HETATM    4  O   UNL     1      -8.345  -1.762   0.643  1.00  0.00           O  
HETATM    5  C   UNL     1      -4.300   1.288  -0.082  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.203   1.606  -1.097  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.351   0.857  -1.254  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.608  -0.207  -0.408  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.717  -0.527   0.601  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.565   0.213   0.769  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.064   2.082   0.088  1.00  0.00           C  
HETATM   12  O   UNL     1      -2.833   3.014  -0.657  1.00  0.00           O  
HETATM   13  N   UNL     1      -2.194   1.773   1.070  1.00  0.00           N  
HETATM   14  C   UNL     1      -0.970   2.559   1.238  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.164   2.004   2.414  1.00  0.00           C  
HETATM   16  O   UNL     1       0.277   0.680   2.106  1.00  0.00           O  
HETATM   17  C   UNL     1       1.043   0.066   3.145  1.00  0.00           C  
HETATM   18  C   UNL     1       1.459  -1.340   2.708  1.00  0.00           C  
HETATM   19  O   UNL     1       2.343  -1.249   1.589  1.00  0.00           O  
HETATM   20  C   UNL     1       2.794  -2.514   1.100  1.00  0.00           C  
HETATM   21  C   UNL     1       3.730  -2.296  -0.091  1.00  0.00           C  
HETATM   22  N   UNL     1       4.942  -1.599   0.360  1.00  0.00           N  
HETATM   23  C   UNL     1       5.948  -1.582  -0.682  1.00  0.00           C  
HETATM   24  C   UNL     1       7.007  -0.517  -0.378  1.00  0.00           C  
HETATM   25  O   UNL     1       7.043   0.331  -1.493  1.00  0.00           O  
HETATM   26  O   UNL     1       7.677  -0.426   0.623  1.00  0.00           O  
HETATM   27  C   UNL     1       4.649  -0.191   0.692  1.00  0.00           C  
HETATM   28  C   UNL     1       3.613   0.496  -0.203  1.00  0.00           C  
HETATM   29  O   UNL     1       4.015   0.413  -1.567  1.00  0.00           O  
HETATM   30  O   UNL     1       2.603   1.030   0.190  1.00  0.00           O  
HETATM   31 CU   UNL     1       5.517   0.416  -1.595  1.00  0.00          Cu  
HETATM   32  H   UNL     1      -6.823  -2.473  -2.026  1.00  0.00           H  
HETATM   33  H   UNL     1      -8.402  -3.035  -1.905  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.004   2.436  -1.759  1.00  0.00           H  
HETATM   35  H   UNL     1      -7.051   1.102  -2.040  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.924  -1.358   1.259  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.870  -0.038   1.556  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.378   1.029   1.665  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.372   2.501   0.329  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.231   3.599   1.436  1.00  0.00           H  
HETATM   41  H   UNL     1       0.701   2.642   2.596  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.791   1.980   3.305  1.00  0.00           H  
HETATM   43  H   UNL     1       1.933   0.664   3.341  1.00  0.00           H  
HETATM   44  H   UNL     1       0.441   0.002   4.051  1.00  0.00           H  
HETATM   45  H   UNL     1       1.967  -1.841   3.532  1.00  0.00           H  
HETATM   46  H   UNL     1       0.574  -1.910   2.426  1.00  0.00           H  
HETATM   47  H   UNL     1       3.329  -3.039   1.891  1.00  0.00           H  
HETATM   48  H   UNL     1       1.937  -3.108   0.785  1.00  0.00           H  
HETATM   49  H   UNL     1       4.003  -3.261  -0.519  1.00  0.00           H  
HETATM   50  H   UNL     1       3.223  -1.694  -0.845  1.00  0.00           H  
HETATM   51  H   UNL     1       6.425  -2.560  -0.738  1.00  0.00           H  
HETATM   52  H   UNL     1       5.474  -1.359  -1.638  1.00  0.00           H  
HETATM   53  H   UNL     1       4.293  -0.149   1.722  1.00  0.00           H  
HETATM   54  H   UNL     1       5.580   0.375   0.635  1.00  0.00           H  
CONECT    1    2    3    3    4                                       
CONECT    1    4    8                                                 
CONECT    2    1   32   33                                            
CONECT    3    1    1                                                 
CONECT    4    1    1                                                 
CONECT    5    6   10   10   11                                       
CONECT    6    5    7    7   34                                       
CONECT    7    6    6    8   35                                       
CONECT    8    1    7    9    9                                       
CONECT    9    8    8   10   36                                       
CONECT   10    5    5    9   37                                       
CONECT   11    5   12   12   13                                       
CONECT   12   11   11                                                 
CONECT   13   11   14   38                                            
CONECT   14   13   15   39   40                                       
CONECT   15   14   16   41   42                                       
CONECT   16   15   17                                                 
CONECT   17   16   18   43   44                                       
CONECT   18   17   19   45   46                                       
CONECT   19   18   20                                                 
CONECT   20   19   21   47   48                                       
CONECT   21   20   22   49   50                                       
CONECT   22   21   23   27                                            
CONECT   23   22   24   51   52                                       
CONECT   24   23   25   26   26                                       
CONECT   25   24   31                                                 
CONECT   26   24   24                                                 
CONECT   27   22   28   53   54                                       
CONECT   28   27   29   30   30                                       
CONECT   29   28   31                                                 
CONECT   30   28   28                                                 
CONECT   31   25   29                                                 
CONECT   32    2                                                      
CONECT   33    2                                                      
CONECT   34    6                                                      
CONECT   35    7                                                      
CONECT   36    9                                                      
CONECT   37   10                                                      
CONECT   38   13                                                      
CONECT   39   14                                                      
CONECT   40   14                                                      
CONECT   41   15                                                      
CONECT   42   15                                                      
CONECT   43   17                                                      
CONECT   44   17                                                      
CONECT   45   18                                                      
CONECT   46   18                                                      
CONECT   47   20                                                      
CONECT   48   20                                                      
CONECT   49   21                                                      
CONECT   50   21                                                      
CONECT   51   23                                                      
CONECT   52   23                                                      
CONECT   53   27                                                      
CONECT   54   27                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
