COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -4.722   3.970  -1.091  1.00  0.00           O  
HETATM    2  N   UNL     1      -4.542   2.880  -0.206  1.00  0.00           N  
HETATM    3  C   UNL     1      -3.599   1.952  -0.463  1.00  0.00           C  
HETATM    4  O   UNL     1      -2.905   2.051  -1.453  1.00  0.00           O  
HETATM    5  C   UNL     1      -3.407   0.791   0.479  1.00  0.00           C  
HETATM    6  N   UNL     1      -2.331  -0.069  -0.019  1.00  0.00           N  
HETATM    7  C   UNL     1      -1.048   0.217   0.278  1.00  0.00           C  
HETATM    8  O   UNL     1      -0.784   1.187   0.957  1.00  0.00           O  
HETATM    9  C   UNL     1       0.059  -0.667  -0.234  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.135  -2.088   0.299  1.00  0.00           C  
HETATM   11  C   UNL     1       0.915  -3.013  -0.319  1.00  0.00           C  
HETATM   12  C   UNL     1       0.800  -4.405   0.307  1.00  0.00           C  
HETATM   13  C   UNL     1       0.683  -3.112  -1.828  1.00  0.00           C  
HETATM   14  N   UNL     1       1.351  -0.147   0.223  1.00  0.00           N  
HETATM   15  C   UNL     1       2.472  -0.423  -0.472  1.00  0.00           C  
HETATM   16  O   UNL     1       2.412  -1.104  -1.478  1.00  0.00           O  
HETATM   17  N   UNL     1       3.660   0.055  -0.052  1.00  0.00           N  
HETATM   18  C   UNL     1       4.879  -0.245  -0.808  1.00  0.00           C  
HETATM   19  C   UNL     1       6.060   0.403  -0.133  1.00  0.00           C  
HETATM   20  C   UNL     1       6.434   1.689  -0.477  1.00  0.00           C  
HETATM   21  C   UNL     1       7.518   2.282   0.142  1.00  0.00           C  
HETATM   22  C   UNL     1       8.228   1.591   1.105  1.00  0.00           C  
HETATM   23  C   UNL     1       7.854   0.305   1.450  1.00  0.00           C  
HETATM   24  C   UNL     1       6.767  -0.287   0.835  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.686  -0.002   0.565  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.538   0.175   1.639  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.710  -0.554   1.718  1.00  0.00           C  
HETATM   28  C   UNL     1      -7.030  -1.459   0.724  1.00  0.00           C  
HETATM   29  C   UNL     1      -6.178  -1.636  -0.350  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.008  -0.903  -0.432  1.00  0.00           C  
HETATM   31  H   UNL     1      -5.421   4.583  -0.824  1.00  0.00           H  
HETATM   32  H   UNL     1      -5.097   2.801   0.585  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.145   1.166   1.468  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.542  -0.844  -0.562  1.00  0.00           H  
HETATM   35  H   UNL     1       0.038  -0.682  -1.324  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.026  -2.088   1.384  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.132  -2.442   0.035  1.00  0.00           H  
HETATM   38  H   UNL     1       1.910  -2.611  -0.130  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.195  -4.807   0.118  1.00  0.00           H  
HETATM   40  H   UNL     1       1.548  -5.064  -0.133  1.00  0.00           H  
HETATM   41  H   UNL     1       0.965  -4.335   1.382  1.00  0.00           H  
HETATM   42  H   UNL     1       0.765  -2.121  -2.273  1.00  0.00           H  
HETATM   43  H   UNL     1       1.431  -3.771  -2.268  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.312  -3.515  -2.017  1.00  0.00           H  
HETATM   45  H   UNL     1       1.399   0.396   1.025  1.00  0.00           H  
HETATM   46  H   UNL     1       3.708   0.598   0.750  1.00  0.00           H  
HETATM   47  H   UNL     1       5.028  -1.324  -0.844  1.00  0.00           H  
HETATM   48  H   UNL     1       4.782   0.143  -1.822  1.00  0.00           H  
HETATM   49  H   UNL     1       5.879   2.229  -1.230  1.00  0.00           H  
HETATM   50  H   UNL     1       7.810   3.287  -0.127  1.00  0.00           H  
HETATM   51  H   UNL     1       9.075   2.054   1.588  1.00  0.00           H  
HETATM   52  H   UNL     1       8.409  -0.235   2.203  1.00  0.00           H  
HETATM   53  H   UNL     1       6.472  -1.289   1.107  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.288   0.882   2.416  1.00  0.00           H  
HETATM   55  H   UNL     1      -7.376  -0.416   2.557  1.00  0.00           H  
HETATM   56  H   UNL     1      -7.945  -2.029   0.786  1.00  0.00           H  
HETATM   57  H   UNL     1      -6.427  -2.343  -1.127  1.00  0.00           H  
HETATM   58  H   UNL     1      -4.342  -1.041  -1.271  1.00  0.00           H  
CONECT    1    2   31                                                 
CONECT    2    3    1   32                                            
CONECT    3    5    4    4    2                                       
CONECT    4    3    3                                                 
CONECT    5   25    6    3   33                                       
CONECT    6    5    7   34                                            
CONECT    7    6    8    8    9                                       
CONECT    8    7    7                                                 
CONECT    9    7   14   10   35                                       
CONECT   10    9   11   36   37                                       
CONECT   11   10   12   13   38                                       
CONECT   12   11   39   40   41                                       
CONECT   13   11   42   43   44                                       
CONECT   14   15    9   45                                            
CONECT   15   16   16   17   14                                       
CONECT   16   15   15                                                 
CONECT   17   18   15   46                                            
CONECT   18   19   17   47   48                                       
CONECT   19   20   18   24   24                                       
CONECT   20   21   21   19   49                                       
CONECT   21   20   20   22   50                                       
CONECT   22   21   23   23   51                                       
CONECT   23   22   22   24   52                                       
CONECT   24   19   19   23   53                                       
CONECT   25   26   26   30    5                                       
CONECT   26   27   25   25   54                                       
CONECT   27   28   28   26   55                                       
CONECT   28   27   27   29   56                                       
CONECT   29   28   30   30   57                                       
CONECT   30   29   29   25   58                                       
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    5                                                      
CONECT   34    6                                                      
CONECT   35    9                                                      
CONECT   36   10                                                      
CONECT   37   10                                                      
CONECT   38   11                                                      
CONECT   39   12                                                      
CONECT   40   12                                                      
CONECT   41   12                                                      
CONECT   42   13                                                      
CONECT   43   13                                                      
CONECT   44   13                                                      
CONECT   45   14                                                      
CONECT   46   17                                                      
CONECT   47   18                                                      
CONECT   48   18                                                      
CONECT   49   20                                                      
CONECT   50   21                                                      
CONECT   51   22                                                      
CONECT   52   23                                                      
CONECT   53   24                                                      
CONECT   54   26                                                      
CONECT   55   27                                                      
CONECT   56   28                                                      
CONECT   57   29                                                      
CONECT   58   30                                                      
MASTER        0    0    0    0    0    0    0    0   58    0   58    0
END
