COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.010   2.840   0.958  1.00  0.00           C  
HETATM    2  C   UNL     1       0.150   0.359   0.331  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.332  -0.904  -0.017  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.684  -1.470  -0.142  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.977  -0.964   0.036  1.00  0.00           C  
HETATM    6  C   UNL     1       4.667   0.258  -0.949  1.00  0.00           C  
HETATM    7  C   UNL     1       4.764  -0.331   1.162  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.744   0.883   1.604  1.00  0.00           C  
HETATM    9  N   UNL     1       5.939   0.005   0.718  1.00  0.00           N  
HETATM   10  O   UNL     1       5.907   0.332  -0.445  1.00  0.00           O  
HETATM   11  C   UNL     1      -3.170   0.448   0.443  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.520  -2.811  -0.529  1.00  0.00           C  
HETATM   13  C   UNL     1       4.242   0.585  -2.358  1.00  0.00           C  
HETATM   14  C   UNL     1       3.866  -0.180   0.068  1.00  0.00           C  
HETATM   15  C   UNL     1       2.405  -0.436   0.039  1.00  0.00           C  
HETATM   16  C   UNL     1       0.563  -1.938  -0.335  1.00  0.00           C  
HETATM   17  C   UNL     1       1.509   0.594   0.356  1.00  0.00           C  
HETATM   18  N   UNL     1      -3.727   2.230   1.587  1.00  0.00           N  
HETATM   19  C   UNL     1       4.423  -0.793   2.555  1.00  0.00           C  
HETATM   20  O   UNL     1       1.980   1.825   0.690  1.00  0.00           O  
HETATM   21  C   UNL     1      -4.301   0.014   2.702  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.795   1.588  -0.297  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.126   1.585  -1.648  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.571   2.914  -2.163  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.834   2.319  -2.788  1.00  0.00           C  
HETATM   26  C   UNL     1      -3.904  -3.010  -0.523  1.00  0.00           C  
HETATM   27  C   UNL     1      -2.666  -3.584  -0.719  1.00  0.00           C  
HETATM   28  C   UNL     1       1.930  -1.696  -0.302  1.00  0.00           C  
HETATM   29  N   UNL     1      -3.130   2.646   0.391  1.00  0.00           N  
HETATM   30  N   UNL     1      -4.031  -1.747  -0.160  1.00  0.00           N  
HETATM   31  N   UNL     1      -0.174  -3.073  -0.639  1.00  0.00           N  
HETATM   32  H   UNL     1       0.390   2.993   0.074  1.00  0.00           H  
HETATM   33  H   UNL     1       0.382   2.530   1.793  1.00  0.00           H  
HETATM   34  H   UNL     1       1.518   3.770   1.211  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.540   1.153   0.575  1.00  0.00           H  
HETATM   36  H   UNL     1       3.963   1.637  -2.418  1.00  0.00           H  
HETATM   37  H   UNL     1       5.068   0.388  -3.041  1.00  0.00           H  
HETATM   38  H   UNL     1       3.388  -0.034  -2.633  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.069   2.811   2.284  1.00  0.00           H  
HETATM   40  H   UNL     1       4.517  -1.878   2.611  1.00  0.00           H  
HETATM   41  H   UNL     1       5.105  -0.332   3.268  1.00  0.00           H  
HETATM   42  H   UNL     1       3.399  -0.505   2.792  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.324  -0.271   2.456  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.688  -0.882   2.802  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.293   0.566   3.642  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.575   0.679  -1.898  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.690   3.791  -1.526  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.655   2.883  -2.753  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.749   1.895  -3.789  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.784   2.803  -2.562  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.792  -3.608  -0.670  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.585  -4.619  -1.017  1.00  0.00           H  
HETATM   53  H   UNL     1       2.624  -2.486  -0.546  1.00  0.00           H  
HETATM   54  H   UNL     1       0.206  -3.929  -0.893  1.00  0.00           H  
CONECT    1   20   32   33   34                                       
CONECT    2   17   17    3   35                                       
CONECT    3   16   16    4    2                                       
CONECT    4   12    3    5    5                                       
CONECT    5    4    4   30   11                                       
CONECT    6   10   13   14   14                                       
CONECT    7    9    9   19   14                                       
CONECT    8   11   11   21   18                                       
CONECT    9   10    7    7                                            
CONECT   10    9    6                                                 
CONECT   11    5    8    8   22                                       
CONECT   12   31   27   27    4                                       
CONECT   13    6   36   37   38                                       
CONECT   14    7    6    6   15                                       
CONECT   15   14   28   28   17                                       
CONECT   16   28   31    3    3                                       
CONECT   17   15   20    2    2                                       
CONECT   18    8   29   39                                            
CONECT   19    7   40   41   42                                       
CONECT   20   17    1                                                 
CONECT   21    8   43   44   45                                       
CONECT   22   11   23   29   29                                       
CONECT   23   25   22   24   46                                       
CONECT   24   23   25   47   48                                       
CONECT   25   23   24   49   50                                       
CONECT   26   27   30   30   51                                       
CONECT   27   12   12   26   52                                       
CONECT   28   15   15   16   53                                       
CONECT   29   22   22   18                                            
CONECT   30   26   26    5                                            
CONECT   31   16   12   54                                            
CONECT   32    1                                                      
CONECT   33    1                                                      
CONECT   34    1                                                      
CONECT   35    2                                                      
CONECT   36   13                                                      
CONECT   37   13                                                      
CONECT   38   13                                                      
CONECT   39   18                                                      
CONECT   40   19                                                      
CONECT   41   19                                                      
CONECT   42   19                                                      
CONECT   43   21                                                      
CONECT   44   21                                                      
CONECT   45   21                                                      
CONECT   46   23                                                      
CONECT   47   24                                                      
CONECT   48   24                                                      
CONECT   49   25                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
CONECT   52   27                                                      
CONECT   53   28                                                      
CONECT   54   31                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
