COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.898   0.579   0.625  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.831   1.309   1.596  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.230   1.258   0.351  1.00  0.00           C  
HETATM    4  C   UNL     1      -7.264   0.788  -2.435  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.959   0.864  -0.756  1.00  0.00           C  
HETATM    6  C   UNL     1       1.223   1.628   0.202  1.00  0.00           C  
HETATM    7  C   UNL     1       3.378   0.623   0.271  1.00  0.00           C  
HETATM    8  N   UNL     1      -7.451   0.135  -1.136  1.00  0.00           N  
HETATM    9  C   UNL     1      -8.623  -0.465  -0.693  1.00  0.00           C  
HETATM   10  C   UNL     1      -9.928  -0.710  -1.133  1.00  0.00           C  
HETATM   11  C   UNL     1     -10.710  -1.363  -0.281  1.00  0.00           C  
HETATM   12  S   UNL     1      -9.834  -1.734   1.195  1.00  0.00           S  
HETATM   13  C   UNL     1      -8.381  -0.958   0.576  1.00  0.00           C  
HETATM   14  C   UNL     1      -7.049  -0.657   0.913  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.492   0.010  -0.153  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.116   0.504  -0.230  1.00  0.00           C  
HETATM   17  O   UNL     1      -4.757   1.158  -1.193  1.00  0.00           O  
HETATM   18  N   UNL     1      -4.247   0.236   0.764  1.00  0.00           N  
HETATM   19  C   UNL     1      -2.162   0.970   1.736  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.291   0.525  -0.623  1.00  0.00           C  
HETATM   21  O   UNL     1       2.032   0.462   0.375  1.00  0.00           O  
HETATM   22  C   UNL     1       4.221  -0.467   0.428  1.00  0.00           C  
HETATM   23  C   UNL     1       5.588  -0.303   0.322  1.00  0.00           C  
HETATM   24  C   UNL     1       6.118   0.951   0.059  1.00  0.00           C  
HETATM   25  C   UNL     1       5.275   2.042  -0.098  1.00  0.00           C  
HETATM   26  C   UNL     1       3.907   1.877   0.002  1.00  0.00           C  
HETATM   27  O   UNL     1       7.464   1.113  -0.046  1.00  0.00           O  
HETATM   28  C   UNL     1       8.274  -0.048   0.155  1.00  0.00           C  
HETATM   29  C   UNL     1       8.363  -0.841  -1.152  1.00  0.00           C  
HETATM   30  C   UNL     1       9.281  -2.049  -0.948  1.00  0.00           C  
HETATM   31  N   UNL     1      10.615  -1.589  -0.541  1.00  0.00           N  
HETATM   32  C   UNL     1      10.561  -0.865   0.735  1.00  0.00           C  
HETATM   33  C   UNL     1       9.682   0.378   0.581  1.00  0.00           C  
HETATM   34  C   UNL     1      11.560  -2.712  -0.471  1.00  0.00           C  
HETATM   35  H   UNL     1      -0.257   1.612   2.459  1.00  0.00           H  
HETATM   36  H   UNL     1      -7.434   1.860  -2.331  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.246   0.614  -2.785  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.971   0.376  -3.154  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.487   0.826  -1.727  1.00  0.00           H  
HETATM   40  H   UNL     1       1.392   2.043  -0.791  1.00  0.00           H  
HETATM   41  H   UNL     1       1.489   2.369   0.956  1.00  0.00           H  
HETATM   42  H   UNL     1     -10.277  -0.389  -2.103  1.00  0.00           H  
HETATM   43  H   UNL     1     -11.740  -1.628  -0.469  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.552  -0.907   1.839  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.556  -0.196   1.575  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.631   1.010   2.708  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.859   0.216  -1.488  1.00  0.00           H  
HETATM   48  H   UNL     1       3.808  -1.443   0.634  1.00  0.00           H  
HETATM   49  H   UNL     1       6.245  -1.151   0.445  1.00  0.00           H  
HETATM   50  H   UNL     1       5.688   3.019  -0.302  1.00  0.00           H  
HETATM   51  H   UNL     1       3.251   2.726  -0.120  1.00  0.00           H  
HETATM   52  H   UNL     1       7.831  -0.671   0.931  1.00  0.00           H  
HETATM   53  H   UNL     1       7.369  -1.184  -1.438  1.00  0.00           H  
HETATM   54  H   UNL     1       8.769  -0.204  -1.938  1.00  0.00           H  
HETATM   55  H   UNL     1       8.866  -2.693  -0.171  1.00  0.00           H  
HETATM   56  H   UNL     1       9.358  -2.608  -1.880  1.00  0.00           H  
HETATM   57  H   UNL     1      10.141  -1.514   1.503  1.00  0.00           H  
HETATM   58  H   UNL     1      11.568  -0.564   1.025  1.00  0.00           H  
HETATM   59  H   UNL     1      10.109   1.034  -0.177  1.00  0.00           H  
HETATM   60  H   UNL     1       9.630   0.907   1.533  1.00  0.00           H  
HETATM   61  H   UNL     1      11.636  -3.185  -1.450  1.00  0.00           H  
HETATM   62  H   UNL     1      12.540  -2.343  -0.168  1.00  0.00           H  
HETATM   63  H   UNL     1      11.204  -3.440   0.258  1.00  0.00           H  
CONECT    1   19   19   20   18                                       
CONECT    2    3    3   19   35                                       
CONECT    3    6    2    2    5                                       
CONECT    4    8   36   37   38                                       
CONECT    5    3   20   20   39                                       
CONECT    6   21    3   40   41                                       
CONECT    7   26   26   22   21                                       
CONECT    8    4   15    9                                            
CONECT    9    8   13   13   10                                       
CONECT   10    9   11   11   42                                       
CONECT   11   10   10   12   43                                       
CONECT   12   13   11                                                 
CONECT   13   14    9    9   12                                       
CONECT   14   15   15   13   44                                       
CONECT   15   16    8   14   14                                       
CONECT   16   17   17   18   15                                       
CONECT   17   16   16                                                 
CONECT   18    1   16   45                                            
CONECT   19    2    1    1   46                                       
CONECT   20    5    5    1   47                                       
CONECT   21    6    7                                                 
CONECT   22   23   23    7   48                                       
CONECT   23   24   22   22   49                                       
CONECT   24   27   25   25   23                                       
CONECT   25   24   24   26   50                                       
CONECT   26   25    7    7   51                                       
CONECT   27   28   24                                                 
CONECT   28   29   33   27   52                                       
CONECT   29   30   28   53   54                                       
CONECT   30   31   29   55   56                                       
CONECT   31   34   30   32                                            
CONECT   32   31   33   57   58                                       
CONECT   33   32   28   59   60                                       
CONECT   34   31   61   62   63                                       
CONECT   35    2                                                      
CONECT   36    4                                                      
CONECT   37    4                                                      
CONECT   38    4                                                      
CONECT   39    5                                                      
CONECT   40    6                                                      
CONECT   41    6                                                      
CONECT   42   10                                                      
CONECT   43   11                                                      
CONECT   44   14                                                      
CONECT   45   18                                                      
CONECT   46   19                                                      
CONECT   47   20                                                      
CONECT   48   22                                                      
CONECT   49   23                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
CONECT   52   28                                                      
CONECT   53   29                                                      
CONECT   54   29                                                      
CONECT   55   30                                                      
CONECT   56   30                                                      
CONECT   57   32                                                      
CONECT   58   32                                                      
CONECT   59   33                                                      
CONECT   60   33                                                      
CONECT   61   34                                                      
CONECT   62   34                                                      
CONECT   63   34                                                      
MASTER        0    0    0    0    0    0    0    0   63    0   63    0
END
