COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.529  -0.504   0.411  1.00  0.00           C  
HETATM    2  O   UNL     1       0.733   0.407   0.507  1.00  0.00           O  
HETATM    3  C   UNL     1       3.008  -0.222   0.474  1.00  0.00           C  
HETATM    4  C   UNL     1       3.569  -0.125  -0.946  1.00  0.00           C  
HETATM    5  C   UNL     1       5.082   0.097  -0.882  1.00  0.00           C  
HETATM    6  C   UNL     1       5.754  -1.139  -0.280  1.00  0.00           C  
HETATM    7  C   UNL     1       7.266  -0.916  -0.216  1.00  0.00           C  
HETATM    8  C   UNL     1       7.807  -0.678  -1.628  1.00  0.00           C  
HETATM    9  C   UNL     1       7.135   0.558  -2.230  1.00  0.00           C  
HETATM   10  C   UNL     1       5.622   0.335  -2.293  1.00  0.00           C  
HETATM   11  N   UNL     1       3.235   1.047   1.178  1.00  0.00           N  
HETATM   12  C   UNL     1       2.722   2.181   0.397  1.00  0.00           C  
HETATM   13  C   UNL     1       3.092   3.471   1.082  1.00  0.00           C  
HETATM   14  O   UNL     1       2.725   4.646   0.545  1.00  0.00           O  
HETATM   15  O   UNL     1       3.719   3.448   2.115  1.00  0.00           O  
HETATM   16  N   UNL     1       1.090  -1.768   0.247  1.00  0.00           N  
HETATM   17  C   UNL     1      -0.317  -2.173   0.076  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.217  -1.321   0.934  1.00  0.00           C  
HETATM   19  O   UNL     1      -0.796  -0.845   1.967  1.00  0.00           O  
HETATM   20  C   UNL     1      -0.364  -3.649   0.545  1.00  0.00           C  
HETATM   21  C   UNL     1       0.998  -4.183   0.029  1.00  0.00           C  
HETATM   22  C   UNL     1       1.935  -2.970   0.208  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.789   0.378  -0.525  1.00  0.00           C  
HETATM   24  C   UNL     1      -6.889  -0.724   0.273  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.732  -1.002   0.966  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.721  -0.156   0.743  1.00  0.00           C  
HETATM   27  S   UNL     1      -5.174   1.056  -0.369  1.00  0.00           S  
HETATM   28  C   UNL     1      -7.859   0.910  -1.383  1.00  0.00           C  
HETATM   29  N   UNL     1      -9.021   0.316  -1.421  1.00  0.00           N  
HETATM   30  N   UNL     1      -7.634   2.037  -2.147  1.00  0.00           N  
HETATM   31  C   UNL     1      -3.363  -0.260   1.387  1.00  0.00           C  
HETATM   32  N   UNL     1      -2.488  -1.088   0.553  1.00  0.00           N  
HETATM   33  H   UNL     1       3.509  -1.029   1.009  1.00  0.00           H  
HETATM   34  H   UNL     1       3.361  -1.051  -1.483  1.00  0.00           H  
HETATM   35  H   UNL     1       3.101   0.710  -1.466  1.00  0.00           H  
HETATM   36  H   UNL     1       5.295   0.966  -0.260  1.00  0.00           H  
HETATM   37  H   UNL     1       5.369  -1.308   0.725  1.00  0.00           H  
HETATM   38  H   UNL     1       5.541  -2.008  -0.902  1.00  0.00           H  
HETATM   39  H   UNL     1       7.480  -0.047   0.406  1.00  0.00           H  
HETATM   40  H   UNL     1       7.745  -1.796   0.213  1.00  0.00           H  
HETATM   41  H   UNL     1       8.884  -0.520  -1.582  1.00  0.00           H  
HETATM   42  H   UNL     1       7.594  -1.547  -2.250  1.00  0.00           H  
HETATM   43  H   UNL     1       7.348   1.427  -1.607  1.00  0.00           H  
HETATM   44  H   UNL     1       7.520   0.727  -3.235  1.00  0.00           H  
HETATM   45  H   UNL     1       5.409  -0.534  -2.916  1.00  0.00           H  
HETATM   46  H   UNL     1       5.143   1.215  -2.722  1.00  0.00           H  
HETATM   47  H   UNL     1       2.825   1.028   2.099  1.00  0.00           H  
HETATM   48  H   UNL     1       3.158   2.162  -0.602  1.00  0.00           H  
HETATM   49  H   UNL     1       1.637   2.109   0.321  1.00  0.00           H  
HETATM   50  H   UNL     1       2.986   5.446   1.021  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.611  -2.098  -0.971  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.423  -3.712   1.631  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.194  -4.181   0.079  1.00  0.00           H  
HETATM   54  H   UNL     1       1.336  -5.024   0.635  1.00  0.00           H  
HETATM   55  H   UNL     1       0.929  -4.466  -1.021  1.00  0.00           H  
HETATM   56  H   UNL     1       2.489  -3.064   1.142  1.00  0.00           H  
HETATM   57  H   UNL     1       2.627  -2.909  -0.632  1.00  0.00           H  
HETATM   58  H   UNL     1      -7.787  -1.319   0.353  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.648  -1.841   1.641  1.00  0.00           H  
HETATM   60  H   UNL     1      -9.727   0.666  -1.987  1.00  0.00           H  
HETATM   61  H   UNL     1      -6.770   2.478  -2.118  1.00  0.00           H  
HETATM   62  H   UNL     1      -8.339   2.388  -2.713  1.00  0.00           H  
HETATM   63  H   UNL     1      -2.932   0.736   1.489  1.00  0.00           H  
HETATM   64  H   UNL     1      -3.462  -0.715   2.373  1.00  0.00           H  
HETATM   65  H   UNL     1      -2.825  -1.469  -0.273  1.00  0.00           H  
CONECT    1   16    2    2    3                                       
CONECT    2    1    1                                                 
CONECT    3    1   11    4   33                                       
CONECT    4    3    5   34   35                                       
CONECT    5    4    6   10   36                                       
CONECT    6    5    7   37   38                                       
CONECT    7    6    8   39   40                                       
CONECT    8    7    9   41   42                                       
CONECT    9    8   10   43   44                                       
CONECT   10    5    9   45   46                                       
CONECT   11    3   12   47                                            
CONECT   12   11   13   48   49                                       
CONECT   13   12   14   15   15                                       
CONECT   14   13   50                                                 
CONECT   15   13   13                                                 
CONECT   16   17   22    1                                            
CONECT   17   18   20   16   51                                       
CONECT   18   32   19   19   17                                       
CONECT   19   18   18                                                 
CONECT   20   17   21   52   53                                       
CONECT   21   20   22   54   55                                       
CONECT   22   21   16   56   57                                       
CONECT   23   24   24   27   28                                       
CONECT   24   23   23   25   58                                       
CONECT   25   24   26   26   59                                       
CONECT   26   25   25   27   31                                       
CONECT   27   23   26                                                 
CONECT   28   23   29   29   30                                       
CONECT   29   28   28   60                                            
CONECT   30   28   61   62                                            
CONECT   31   26   32   63   64                                       
CONECT   32   31   18   65                                            
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    4                                                      
CONECT   36    5                                                      
CONECT   37    6                                                      
CONECT   38    6                                                      
CONECT   39    7                                                      
CONECT   40    7                                                      
CONECT   41    8                                                      
CONECT   42    8                                                      
CONECT   43    9                                                      
CONECT   44    9                                                      
CONECT   45   10                                                      
CONECT   46   10                                                      
CONECT   47   11                                                      
CONECT   48   12                                                      
CONECT   49   12                                                      
CONECT   50   14                                                      
CONECT   51   17                                                      
CONECT   52   20                                                      
CONECT   53   20                                                      
CONECT   54   21                                                      
CONECT   55   21                                                      
CONECT   56   22                                                      
CONECT   57   22                                                      
CONECT   58   24                                                      
CONECT   59   25                                                      
CONECT   60   29                                                      
CONECT   61   30                                                      
CONECT   62   30                                                      
CONECT   63   31                                                      
CONECT   64   31                                                      
CONECT   65   32                                                      
MASTER        0    0    0    0    0    0    0    0   65    0   65    0
END
