COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.396  -0.783   0.187  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.344  -1.697   0.041  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.026  -1.204   0.049  1.00  0.00           C  
HETATM    4  N   UNL     1      -0.846   0.107   0.196  1.00  0.00           N  
HETATM    5  N   UNL     1      -3.136   0.494   0.327  1.00  0.00           N  
HETATM    6  C   UNL     1      -0.197   2.563   0.459  1.00  0.00           C  
HETATM    7  C   UNL     1       0.036   4.043   0.771  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.687   4.900  -0.271  1.00  0.00           C  
HETATM    9  O   UNL     1      -0.142   4.638  -1.566  1.00  0.00           O  
HETATM   10  C   UNL     1      -2.178   4.549  -0.263  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.347   3.055  -0.545  1.00  0.00           C  
HETATM   12  N   UNL     1      -1.637   2.278   0.480  1.00  0.00           N  
HETATM   13  C   UNL     1      -1.877   0.928   0.331  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.800  -1.337   0.181  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.949  -2.835   0.017  1.00  0.00           C  
HETATM   16  N   UNL     1      -3.906  -3.584  -0.110  1.00  0.00           N  
HETATM   17  C   UNL     1      -2.647  -3.123  -0.115  1.00  0.00           C  
HETATM   18  O   UNL     1      -1.729  -3.912  -0.242  1.00  0.00           O  
HETATM   19  N   UNL     1       0.051  -2.055  -0.090  1.00  0.00           N  
HETATM   20  C   UNL     1       1.355  -1.563   0.042  1.00  0.00           C  
HETATM   21  C   UNL     1       2.375  -2.111  -0.709  1.00  0.00           C  
HETATM   22  C   UNL     1       3.676  -1.612  -0.570  1.00  0.00           C  
HETATM   23  C   UNL     1       4.957  -1.942  -1.186  1.00  0.00           C  
HETATM   24  N   UNL     1       5.858  -1.149  -0.680  1.00  0.00           N  
HETATM   25  N   UNL     1       5.271  -0.288   0.252  1.00  0.00           N  
HETATM   26  C   UNL     1       5.976   0.741   1.022  1.00  0.00           C  
HETATM   27  C   UNL     1       3.928  -0.561   0.331  1.00  0.00           C  
HETATM   28  C   UNL     1       2.880  -0.026   1.077  1.00  0.00           C  
HETATM   29  C   UNL     1       1.615  -0.517   0.929  1.00  0.00           C  
HETATM   30  H   UNL     1       0.205   2.332  -0.528  1.00  0.00           H  
HETATM   31  H   UNL     1       0.305   1.950   1.208  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.353   4.271   1.764  1.00  0.00           H  
HETATM   33  H   UNL     1       1.105   4.257   0.741  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.559   5.954  -0.028  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.554   5.148  -2.276  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.602   4.785   0.713  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.691   5.125  -1.032  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.406   2.799  -0.526  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.935   2.822  -1.527  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.277  -1.053   1.119  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.348  -0.855  -0.629  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.933  -3.279   0.007  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.096  -2.995  -0.280  1.00  0.00           H  
HETATM   44  H   UNL     1       2.172  -2.917  -1.398  1.00  0.00           H  
HETATM   45  H   UNL     1       5.128  -2.708  -1.928  1.00  0.00           H  
HETATM   46  H   UNL     1       5.968   1.679   0.466  1.00  0.00           H  
HETATM   47  H   UNL     1       5.477   0.883   1.981  1.00  0.00           H  
HETATM   48  H   UNL     1       7.006   0.427   1.190  1.00  0.00           H  
HETATM   49  H   UNL     1       3.068   0.780   1.770  1.00  0.00           H  
HETATM   50  H   UNL     1       0.808  -0.094   1.508  1.00  0.00           H  
CONECT    1    2    2    5   14                                       
CONECT    2    1    1    3   17                                       
CONECT    3    2    4    4   19                                       
CONECT    4    3    3   13                                            
CONECT    5    1   13   13                                            
CONECT    6    7   12   30   31                                       
CONECT    7    6    8   32   33                                       
CONECT    8    7    9   10   34                                       
CONECT    9    8   35                                                 
CONECT   10    8   11   36   37                                       
CONECT   11   10   12   38   39                                       
CONECT   12    6   11   13                                            
CONECT   13    4    5    5   12                                       
CONECT   14    1   15   40   41                                       
CONECT   15   14   16   16   42                                       
CONECT   16   15   15   17                                            
CONECT   17    2   16   18   18                                       
CONECT   18   17   17                                                 
CONECT   19    3   20   43                                            
CONECT   20   19   21   21   29                                       
CONECT   21   20   20   22   44                                       
CONECT   22   21   23   27   27                                       
CONECT   23   22   24   24   45                                       
CONECT   24   23   23   25                                            
CONECT   25   24   26   27                                            
CONECT   26   25   46   47   48                                       
CONECT   27   22   22   25   28                                       
CONECT   28   27   29   29   49                                       
CONECT   29   20   28   28   50                                       
CONECT   30    6                                                      
CONECT   31    6                                                      
CONECT   32    7                                                      
CONECT   33    7                                                      
CONECT   34    8                                                      
CONECT   35    9                                                      
CONECT   36   10                                                      
CONECT   37   10                                                      
CONECT   38   11                                                      
CONECT   39   11                                                      
CONECT   40   14                                                      
CONECT   41   14                                                      
CONECT   42   15                                                      
CONECT   43   19                                                      
CONECT   44   21                                                      
CONECT   45   23                                                      
CONECT   46   26                                                      
CONECT   47   26                                                      
CONECT   48   26                                                      
CONECT   49   28                                                      
CONECT   50   29                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
