COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       2.075   1.664  -0.655  1.00  0.00           N  
HETATM    2  N   UNL     1       1.535   1.629  -1.934  1.00  0.00           N  
HETATM    3  C   UNL     1       0.438   0.912  -1.914  1.00  0.00           C  
HETATM    4  C   UNL     1       0.225   0.451  -0.599  1.00  0.00           C  
HETATM    5  C   UNL     1       1.259   0.935   0.173  1.00  0.00           C  
HETATM    6  N   UNL     1       1.523   0.788   1.501  1.00  0.00           N  
HETATM    7  C   UNL     1       2.714   1.063   1.929  1.00  0.00           C  
HETATM    8  C   UNL     1       3.824   1.503   1.018  1.00  0.00           C  
HETATM    9  C   UNL     1       3.290   2.320  -0.163  1.00  0.00           C  
HETATM   10  N   UNL     1       2.972   3.684   0.281  1.00  0.00           N  
HETATM   11  C   UNL     1       4.540   0.287   0.491  1.00  0.00           C  
HETATM   12  C   UNL     1       5.889   0.115   0.745  1.00  0.00           C  
HETATM   13  C   UNL     1       6.547  -0.999   0.263  1.00  0.00           C  
HETATM   14  C   UNL     1       5.855  -1.947  -0.477  1.00  0.00           C  
HETATM   15  C   UNL     1       4.503  -1.772  -0.731  1.00  0.00           C  
HETATM   16  C   UNL     1       3.847  -0.659  -0.242  1.00  0.00           C  
HETATM   17  O   UNL     1       6.501  -3.044  -0.953  1.00  0.00           O  
HETATM   18  C   UNL     1      -0.900  -0.394  -0.134  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.212  -0.049  -0.453  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.260  -0.844  -0.015  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.000  -1.981   0.741  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.699  -2.323   1.058  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.649  -1.540   0.620  1.00  0.00           C  
HETATM   24  N   UNL     1      -4.577  -0.502  -0.332  1.00  0.00           N  
HETATM   25  C   UNL     1      -5.524  -1.475   0.229  1.00  0.00           C  
HETATM   26  C   UNL     1      -6.945  -1.110  -0.206  1.00  0.00           C  
HETATM   27  N   UNL     1      -7.260   0.251   0.251  1.00  0.00           N  
HETATM   28  C   UNL     1      -6.313   1.224  -0.310  1.00  0.00           C  
HETATM   29  C   UNL     1      -4.892   0.859   0.125  1.00  0.00           C  
HETATM   30  C   UNL     1      -8.644   0.610  -0.083  1.00  0.00           C  
HETATM   31  H   UNL     1      -0.197   0.708  -2.764  1.00  0.00           H  
HETATM   32  H   UNL     1       2.918   0.973   2.985  1.00  0.00           H  
HETATM   33  H   UNL     1       4.528   2.114   1.583  1.00  0.00           H  
HETATM   34  H   UNL     1       2.596   4.233  -0.477  1.00  0.00           H  
HETATM   35  H   UNL     1       6.427   0.853   1.321  1.00  0.00           H  
HETATM   36  H   UNL     1       7.601  -1.133   0.462  1.00  0.00           H  
HETATM   37  H   UNL     1       3.961  -2.509  -1.307  1.00  0.00           H  
HETATM   38  H   UNL     1       2.793  -0.525  -0.435  1.00  0.00           H  
HETATM   39  H   UNL     1       6.493  -3.798  -0.348  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.411   0.836  -1.040  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.817  -2.600   1.082  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.502  -3.207   1.646  1.00  0.00           H  
HETATM   43  H   UNL     1       0.367  -1.813   0.865  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.277  -2.473  -0.133  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.461  -1.458   1.317  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.015  -1.154  -1.293  1.00  0.00           H  
HETATM   47  H   UNL     1      -7.652  -1.814   0.233  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.375   1.207  -1.398  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.559   2.222   0.052  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.822   0.903   1.212  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.185   1.563  -0.314  1.00  0.00           H  
HETATM   52  H   UNL     1      -9.328  -0.088   0.401  1.00  0.00           H  
HETATM   53  H   UNL     1      -8.851   1.622   0.267  1.00  0.00           H  
HETATM   54  H   UNL     1      -8.782   0.564  -1.163  1.00  0.00           H  
HETATM   55  H   UNL     1       4.037   2.354  -0.955  1.00  0.00           H  
HETATM   56  H   UNL     1       2.339   3.670   1.066  1.00  0.00           H  
CONECT    1    5    9    2                                            
CONECT    2    1    3    3                                            
CONECT    3    2    2    4   31                                       
CONECT    4    3    5    5   18                                       
CONECT    5    1    4    4    6                                       
CONECT    6    5    7    7                                            
CONECT    7    6    6   32    8                                       
CONECT    8    7   11   33    9                                       
CONECT    9    1    8   10   55                                       
CONECT   10    9   34   56                                            
CONECT   11    8   12   16   16                                       
CONECT   12   11   13   13   35                                       
CONECT   13   12   12   36   14                                       
CONECT   14   13   17   15   15                                       
CONECT   15   14   14   37   16                                       
CONECT   16   11   11   15   38                                       
CONECT   17   14   39                                                 
CONECT   18    4   23   19   19                                       
CONECT   19   18   18   20   40                                       
CONECT   20   19   21   21   24                                       
CONECT   21   20   20   22   41                                       
CONECT   22   21   42   23   23                                       
CONECT   23   18   22   22   43                                       
CONECT   24   20   25   29                                            
CONECT   25   24   44   45   26                                       
CONECT   26   25   46   47   27                                       
CONECT   27   26   28   30                                            
CONECT   28   27   29   48   49                                       
CONECT   29   28   24   50   51                                       
CONECT   30   27   52   53   54                                       
CONECT   31    3                                                      
CONECT   32    7                                                      
CONECT   33    8                                                      
CONECT   34   10                                                      
CONECT   35   12                                                      
CONECT   36   13                                                      
CONECT   37   15                                                      
CONECT   38   16                                                      
CONECT   39   17                                                      
CONECT   40   19                                                      
CONECT   41   21                                                      
CONECT   42   22                                                      
CONECT   43   23                                                      
CONECT   44   25                                                      
CONECT   45   25                                                      
CONECT   46   26                                                      
CONECT   47   26                                                      
CONECT   48   28                                                      
CONECT   49   28                                                      
CONECT   50   29                                                      
CONECT   51   29                                                      
CONECT   52   30                                                      
CONECT   53   30                                                      
CONECT   54   30                                                      
CONECT   55    9                                                      
CONECT   56   10                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
