COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.606   4.583  -0.811  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.055   5.637  -0.039  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.838   4.095   1.621  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.938   0.400  -1.086  1.00  0.00           C  
HETATM    5  N   UNL     1      -4.519  -0.641  -0.456  1.00  0.00           N  
HETATM    6  C   UNL     1      -5.872  -1.061  -0.831  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.286  -2.236   0.016  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.934  -2.037   1.221  1.00  0.00           C  
HETATM    9  C   UNL     1       4.919   1.523   2.768  1.00  0.00           C  
HETATM   10  C   UNL     1       5.102   0.006   2.839  1.00  0.00           C  
HETATM   11  C   UNL     1       6.421  -0.381   2.167  1.00  0.00           C  
HETATM   12  C   UNL     1       5.127  -0.437   4.304  1.00  0.00           C  
HETATM   13  C   UNL     1       3.837  -0.363   0.849  1.00  0.00           C  
HETATM   14  C   UNL     1       2.657  -0.625  -1.266  1.00  0.00           C  
HETATM   15  C   UNL     1       1.196  -0.853  -1.659  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.524  -0.091  -1.364  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.547   0.832  -0.700  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.774   3.278  -0.367  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.670   5.394   1.176  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.393   3.037   0.854  1.00  0.00           C  
HETATM   21  C   UNL     1      -7.064  -4.305   1.601  1.00  0.00           C  
HETATM   22  C   UNL     1      -6.425  -4.582   0.407  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.026  -3.531  -0.405  1.00  0.00           C  
HETATM   24  C   UNL     1       3.558  -1.536  -2.102  1.00  0.00           C  
HETATM   25  C   UNL     1       5.002  -1.226  -1.804  1.00  0.00           C  
HETATM   26  C   UNL     1       5.657  -1.896  -0.788  1.00  0.00           C  
HETATM   27  C   UNL     1       6.982  -1.611  -0.514  1.00  0.00           C  
HETATM   28  C   UNL     1       7.651  -0.656  -1.256  1.00  0.00           C  
HETATM   29  C   UNL     1       6.995   0.015  -2.271  1.00  0.00           C  
HETATM   30  C   UNL     1       5.672  -0.274  -2.549  1.00  0.00           C  
HETATM   31  N   UNL     1       2.834  -0.934   0.155  1.00  0.00           N  
HETATM   32  N   UNL     1      -2.323   2.210  -1.145  1.00  0.00           N  
HETATM   33  N   UNL     1      -7.299  -3.060   1.967  1.00  0.00           N  
HETATM   34  O   UNL     1       4.000  -0.647   2.155  1.00  0.00           O  
HETATM   35  O   UNL     1       4.595   0.410   0.296  1.00  0.00           O  
HETATM   36  O   UNL     1      -4.535   0.988  -1.962  1.00  0.00           O  
HETATM   37  S   UNL     1       0.140   0.329  -0.776  1.00  0.00           S  
HETATM   38  H   UNL     1      -2.130   4.774  -1.761  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.924   6.652  -0.384  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.319   3.909   2.570  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.042  -1.111   0.245  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.566  -0.236  -0.672  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.885  -1.349  -1.883  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.144  -1.031   1.554  1.00  0.00           H  
HETATM   45  H   UNL     1       3.980   1.799   3.247  1.00  0.00           H  
HETATM   46  H   UNL     1       5.747   2.013   3.282  1.00  0.00           H  
HETATM   47  H   UNL     1       4.902   1.839   1.725  1.00  0.00           H  
HETATM   48  H   UNL     1       7.248   0.109   2.681  1.00  0.00           H  
HETATM   49  H   UNL     1       6.551  -1.462   2.217  1.00  0.00           H  
HETATM   50  H   UNL     1       6.403  -0.066   1.124  1.00  0.00           H  
HETATM   51  H   UNL     1       4.187  -0.161   4.782  1.00  0.00           H  
HETATM   52  H   UNL     1       5.257  -1.518   4.354  1.00  0.00           H  
HETATM   53  H   UNL     1       5.954   0.053   4.817  1.00  0.00           H  
HETATM   54  H   UNL     1       2.924   0.416  -1.448  1.00  0.00           H  
HETATM   55  H   UNL     1       1.082  -0.709  -2.734  1.00  0.00           H  
HETATM   56  H   UNL     1       0.902  -1.869  -1.396  1.00  0.00           H  
HETATM   57  H   UNL     1      -1.749  -1.127  -1.107  1.00  0.00           H  
HETATM   58  H   UNL     1      -1.569   0.034  -2.445  1.00  0.00           H  
HETATM   59  H   UNL     1      -2.437   0.778   0.383  1.00  0.00           H  
HETATM   60  H   UNL     1      -4.019   6.219   1.778  1.00  0.00           H  
HETATM   61  H   UNL     1      -3.524   2.023   1.202  1.00  0.00           H  
HETATM   62  H   UNL     1      -7.378  -5.118   2.239  1.00  0.00           H  
HETATM   63  H   UNL     1      -6.235  -5.603   0.113  1.00  0.00           H  
HETATM   64  H   UNL     1      -5.525  -3.717  -1.343  1.00  0.00           H  
HETATM   65  H   UNL     1       3.351  -2.578  -1.855  1.00  0.00           H  
HETATM   66  H   UNL     1       3.361  -1.368  -3.161  1.00  0.00           H  
HETATM   67  H   UNL     1       5.134  -2.643  -0.209  1.00  0.00           H  
HETATM   68  H   UNL     1       7.494  -2.135   0.279  1.00  0.00           H  
HETATM   69  H   UNL     1       8.686  -0.433  -1.041  1.00  0.00           H  
HETATM   70  H   UNL     1       7.518   0.762  -2.850  1.00  0.00           H  
HETATM   71  H   UNL     1       5.160   0.250  -3.342  1.00  0.00           H  
HETATM   72  H   UNL     1       2.228  -1.551   0.596  1.00  0.00           H  
HETATM   73  H   UNL     1      -1.861   2.380  -1.981  1.00  0.00           H  
CONECT    1   18   18    2   38                                       
CONECT    2    1   19   19   39                                       
CONECT    3   20   20   19   40                                       
CONECT    4    5   36   36   17                                       
CONECT    5    6    4   41                                            
CONECT    6    7    5   42   43                                       
CONECT    7   23   23    8    6                                       
CONECT    8   33   33    7   44                                       
CONECT    9   10   45   46   47                                       
CONECT   10   11    9   34   12                                       
CONECT   11   10   48   49   50                                       
CONECT   12   10   51   52   53                                       
CONECT   13   34   35   35   31                                       
CONECT   14   31   15   24   54                                       
CONECT   15   14   37   55   56                                       
CONECT   16   37   17   57   58                                       
CONECT   17   16    4   32   59                                       
CONECT   18   32    1    1   20                                       
CONECT   19    2    2    3   60                                       
CONECT   20   18    3    3   61                                       
CONECT   21   22   22   33   62                                       
CONECT   22   21   21   23   63                                       
CONECT   23   22    7    7   64                                       
CONECT   24   14   25   65   66                                       
CONECT   25   30   24   26   26                                       
CONECT   26   25   25   27   67                                       
CONECT   27   28   28   26   68                                       
CONECT   28   29   27   27   69                                       
CONECT   29   30   30   28   70                                       
CONECT   30   29   29   25   71                                       
CONECT   31   13   14   72                                            
CONECT   32   17   18   73                                            
CONECT   33   21    8    8                                            
CONECT   34   10   13                                                 
CONECT   35   13   13                                                 
CONECT   36    4    4                                                 
CONECT   37   15   16                                                 
CONECT   38    1                                                      
CONECT   39    2                                                      
CONECT   40    3                                                      
CONECT   41    5                                                      
CONECT   42    6                                                      
CONECT   43    6                                                      
CONECT   44    8                                                      
CONECT   45    9                                                      
CONECT   46    9                                                      
CONECT   47    9                                                      
CONECT   48   11                                                      
CONECT   49   11                                                      
CONECT   50   11                                                      
CONECT   51   12                                                      
CONECT   52   12                                                      
CONECT   53   12                                                      
CONECT   54   14                                                      
CONECT   55   15                                                      
CONECT   56   15                                                      
CONECT   57   16                                                      
CONECT   58   16                                                      
CONECT   59   17                                                      
CONECT   60   19                                                      
CONECT   61   20                                                      
CONECT   62   21                                                      
CONECT   63   22                                                      
CONECT   64   23                                                      
CONECT   65   24                                                      
CONECT   66   24                                                      
CONECT   67   26                                                      
CONECT   68   27                                                      
CONECT   69   28                                                      
CONECT   70   29                                                      
CONECT   71   30                                                      
CONECT   72   31                                                      
CONECT   73   32                                                      
MASTER        0    0    0    0    0    0    0    0   73    0   73    0
END
