COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.073   1.595  -1.941  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.904   1.429  -0.430  1.00  0.00           C  
HETATM    3  N   UNL     1      -3.583   0.032  -0.125  1.00  0.00           N  
HETATM    4  C   UNL     1      -2.306  -0.395  -0.185  1.00  0.00           C  
HETATM    5  O   UNL     1      -1.420   0.380  -0.492  1.00  0.00           O  
HETATM    6  C   UNL     1      -1.985  -1.795   0.121  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.864  -2.776   0.478  1.00  0.00           C  
HETATM    8  N   UNL     1      -2.198  -3.938   0.679  1.00  0.00           N  
HETATM    9  C   UNL     1      -0.849  -3.763   0.461  1.00  0.00           C  
HETATM   10  N   UNL     1       0.194  -4.582   0.529  1.00  0.00           N  
HETATM   11  C   UNL     1       1.404  -4.133   0.260  1.00  0.00           C  
HETATM   12  C   UNL     1       1.602  -2.800  -0.095  1.00  0.00           C  
HETATM   13  N   UNL     1       0.572  -1.971  -0.167  1.00  0.00           N  
HETATM   14  C   UNL     1      -0.651  -2.420   0.097  1.00  0.00           C  
HETATM   15  O   UNL     1       2.852  -2.350  -0.369  1.00  0.00           O  
HETATM   16  C   UNL     1       2.989  -1.071  -0.808  1.00  0.00           C  
HETATM   17  C   UNL     1       2.898  -0.015   0.086  1.00  0.00           C  
HETATM   18  C   UNL     1       3.037   1.287  -0.360  1.00  0.00           C  
HETATM   19  C   UNL     1       2.980   2.595   0.401  1.00  0.00           C  
HETATM   20  N   UNL     1       1.860   2.585   1.346  1.00  0.00           N  
HETATM   21  C   UNL     1       2.024   2.066   2.579  1.00  0.00           C  
HETATM   22  C   UNL     1       0.872   2.056   3.551  1.00  0.00           C  
HETATM   23  O   UNL     1       3.098   1.608   2.907  1.00  0.00           O  
HETATM   24  C   UNL     1       2.763   3.679  -0.675  1.00  0.00           C  
HETATM   25  C   UNL     1       3.381   3.029  -1.931  1.00  0.00           C  
HETATM   26  C   UNL     1       3.267   1.537  -1.701  1.00  0.00           C  
HETATM   27  C   UNL     1       3.359   0.482  -2.594  1.00  0.00           C  
HETATM   28  C   UNL     1       3.225  -0.819  -2.152  1.00  0.00           C  
HETATM   29  C   UNL     1      -5.205   1.819   0.275  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.712   3.249   0.080  1.00  0.00           C  
HETATM   31  C   UNL     1      -6.431   2.083  -0.601  1.00  0.00           C  
HETATM   32  H   UNL     1      -3.147   1.317  -2.443  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.882   0.952  -2.289  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.312   2.634  -2.168  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.095   2.072  -0.082  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.290  -0.585   0.120  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.370   1.355   1.247  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.931  -2.646   0.584  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.612  -4.775   0.941  1.00  0.00           H  
HETATM   40  H   UNL     1       2.249  -4.803   0.317  1.00  0.00           H  
HETATM   41  H   UNL     1       2.718  -0.210   1.133  1.00  0.00           H  
HETATM   42  H   UNL     1       3.301  -1.638  -2.851  1.00  0.00           H  
HETATM   43  H   UNL     1       3.918   2.766   0.929  1.00  0.00           H  
HETATM   44  H   UNL     1       1.002   2.951   1.084  1.00  0.00           H  
HETATM   45  H   UNL     1       1.701   3.873  -0.822  1.00  0.00           H  
HETATM   46  H   UNL     1       3.292   4.596  -0.414  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.003   2.506   3.082  1.00  0.00           H  
HETATM   48  H   UNL     1       0.645   1.028   3.834  1.00  0.00           H  
HETATM   49  H   UNL     1       1.142   2.627   4.440  1.00  0.00           H  
HETATM   50  H   UNL     1       2.821   3.317  -2.821  1.00  0.00           H  
HETATM   51  H   UNL     1       4.427   3.317  -2.031  1.00  0.00           H  
HETATM   52  H   UNL     1       3.538   0.678  -3.641  1.00  0.00           H  
HETATM   53  H   UNL     1      -6.212   3.725   0.924  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.119   3.912  -0.550  1.00  0.00           H  
HETATM   55  H   UNL     1      -6.311   1.978  -1.679  1.00  0.00           H  
HETATM   56  H   UNL     1      -7.404   1.791  -0.205  1.00  0.00           H  
CONECT    1    2   32   33   34                                       
CONECT    2    1    3   29   35                                       
CONECT    3    2    4   36                                            
CONECT    4    3    5    5    6                                       
CONECT    5    4    4                                                 
CONECT    6    4    7    7   14                                       
CONECT    7    6    6    8   38                                       
CONECT    8    7    9   39                                            
CONECT    9    8   10   14   14                                       
CONECT   10    9   11   11                                            
CONECT   11   10   10   12   40                                       
CONECT   12   11   13   13   15                                       
CONECT   13   12   12   14                                            
CONECT   14    6    9    9   13                                       
CONECT   15   12   16                                                 
CONECT   16   15   17   28   28                                       
CONECT   17   16   18   18   41                                       
CONECT   18   17   17   19   26                                       
CONECT   19   18   20   24   43                                       
CONECT   20   19   21   44                                            
CONECT   21   20   22   23   23                                       
CONECT   22   21   47   48   49                                       
CONECT   23   21   21                                                 
CONECT   24   19   25   45   46                                       
CONECT   25   24   26   50   51                                       
CONECT   26   18   25   27   27                                       
CONECT   27   26   26   28   52                                       
CONECT   28   16   16   27   42                                       
CONECT   29    2   30   31   37                                       
CONECT   30   29   31   53   54                                       
CONECT   31   29   30   55   56                                       
CONECT   32    1                                                      
CONECT   33    1                                                      
CONECT   34    1                                                      
CONECT   35    2                                                      
CONECT   36    3                                                      
CONECT   37   29                                                      
CONECT   38    7                                                      
CONECT   39    8                                                      
CONECT   40   11                                                      
CONECT   41   17                                                      
CONECT   42   28                                                      
CONECT   43   19                                                      
CONECT   44   20                                                      
CONECT   45   24                                                      
CONECT   46   24                                                      
CONECT   47   22                                                      
CONECT   48   22                                                      
CONECT   49   22                                                      
CONECT   50   25                                                      
CONECT   51   25                                                      
CONECT   52   27                                                      
CONECT   53   30                                                      
CONECT   54   30                                                      
CONECT   55   31                                                      
CONECT   56   31                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
