COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -1.936  -0.644  -6.882  1.00  0.00           N  
HETATM    2  O   UNL     1      -2.703  -0.681  -8.071  1.00  0.00           O  
HETATM    3  O   UNL     1      -3.353   0.778  -5.933  1.00  0.00           O  
HETATM    4  C   UNL     1      -2.334   0.119  -5.846  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.364  -0.599  -4.504  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.534   0.157  -4.605  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.947   0.949  -3.531  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.201   0.984  -2.374  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.033   0.227  -2.275  1.00  0.00           C  
HETATM   10  C   UNL     1       0.382  -0.559  -3.349  1.00  0.00           C  
HETATM   11  C   UNL     1       0.770   0.265  -1.029  1.00  0.00           C  
HETATM   12  C   UNL     1       0.133   0.280   0.210  1.00  0.00           C  
HETATM   13  C   UNL     1       0.883   0.314   1.377  1.00  0.00           C  
HETATM   14  C   UNL     1       2.268   0.335   1.314  1.00  0.00           C  
HETATM   15  C   UNL     1       2.912   0.320   0.075  1.00  0.00           C  
HETATM   16  C   UNL     1       2.160   0.291  -1.097  1.00  0.00           C  
HETATM   17  C   UNL     1       4.389   0.342   0.008  1.00  0.00           C  
HETATM   18  O   UNL     1       4.950   1.062  -0.794  1.00  0.00           O  
HETATM   19  N   UNL     1       5.113  -0.436   0.836  1.00  0.00           N  
HETATM   20  C   UNL     1       6.572  -0.314   0.867  1.00  0.00           C  
HETATM   21  C   UNL     1       4.440  -1.405   1.705  1.00  0.00           C  
HETATM   22  N   UNL     1       0.241   0.328   2.620  1.00  0.00           N  
HETATM   23  C   UNL     1      -0.920  -0.335   2.786  1.00  0.00           C  
HETATM   24  O   UNL     1      -1.345  -1.047   1.897  1.00  0.00           O  
HETATM   25  C   UNL     1      -2.879  -0.882   4.223  1.00  0.00           C  
HETATM   26  C   UNL     1      -3.580  -0.749   5.403  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.094   0.062   6.413  1.00  0.00           C  
HETATM   28  C   UNL     1      -1.902   0.745   6.246  1.00  0.00           C  
HETATM   29  C   UNL     1      -1.188   0.615   5.072  1.00  0.00           C  
HETATM   30  C   UNL     1      -1.676  -0.196   4.048  1.00  0.00           C  
HETATM   31  C   UNL     1      -3.865   0.203   7.700  1.00  0.00           C  
HETATM   32  H   UNL     1      -1.123  -1.170  -6.812  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.248  -1.281  -8.679  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.044  -1.212  -5.334  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.851   1.535  -3.607  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.519   1.596  -1.544  1.00  0.00           H  
HETATM   37  H   UNL     1       1.287  -1.144  -3.270  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.945   0.264   0.262  1.00  0.00           H  
HETATM   39  H   UNL     1       2.850   0.362   2.224  1.00  0.00           H  
HETATM   40  H   UNL     1       2.655   0.280  -2.057  1.00  0.00           H  
HETATM   41  H   UNL     1       6.980  -1.019   1.591  1.00  0.00           H  
HETATM   42  H   UNL     1       6.976  -0.533  -0.120  1.00  0.00           H  
HETATM   43  H   UNL     1       6.846   0.701   1.154  1.00  0.00           H  
HETATM   44  H   UNL     1       3.375  -1.421   1.475  1.00  0.00           H  
HETATM   45  H   UNL     1       4.863  -2.396   1.539  1.00  0.00           H  
HETATM   46  H   UNL     1       4.582  -1.119   2.747  1.00  0.00           H  
HETATM   47  H   UNL     1       0.631   0.816   3.362  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.260  -1.516   3.436  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.511  -1.279   5.540  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.528   1.378   7.037  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.258   1.149   4.943  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.538  -0.560   8.405  1.00  0.00           H  
HETATM   53  H   UNL     1      -3.686   1.191   8.125  1.00  0.00           H  
HETATM   54  H   UNL     1      -4.930   0.082   7.500  1.00  0.00           H  
CONECT    1    2    4   32                                            
CONECT    2    1   33                                                 
CONECT    3    4    4                                                 
CONECT    4    1    3    3    6                                       
CONECT    5    6    6   10   34                                       
CONECT    6    4    5    5    7                                       
CONECT    7    6    8    8   35                                       
CONECT    8    7    7    9   36                                       
CONECT    9    8   10   10   11                                       
CONECT   10    5    9    9   37                                       
CONECT   11    9   12   12   16                                       
CONECT   12   11   11   13   38                                       
CONECT   13   12   14   14   22                                       
CONECT   14   13   13   15   39                                       
CONECT   15   14   16   16   17                                       
CONECT   16   11   15   15   40                                       
CONECT   17   15   18   18   19                                       
CONECT   18   17   17                                                 
CONECT   19   17   20   21                                            
CONECT   20   19   41   42   43                                       
CONECT   21   19   44   45   46                                       
CONECT   22   13   23   47                                            
CONECT   23   22   24   24   30                                       
CONECT   24   23   23                                                 
CONECT   25   26   26   30   48                                       
CONECT   26   25   25   27   49                                       
CONECT   27   26   28   28   31                                       
CONECT   28   27   27   29   50                                       
CONECT   29   28   30   30   51                                       
CONECT   30   23   25   29   29                                       
CONECT   31   27   52   53   54                                       
CONECT   32    1                                                      
CONECT   33    2                                                      
CONECT   34    5                                                      
CONECT   35    7                                                      
CONECT   36    8                                                      
CONECT   37   10                                                      
CONECT   38   12                                                      
CONECT   39   14                                                      
CONECT   40   16                                                      
CONECT   41   20                                                      
CONECT   42   20                                                      
CONECT   43   20                                                      
CONECT   44   21                                                      
CONECT   45   21                                                      
CONECT   46   21                                                      
CONECT   47   22                                                      
CONECT   48   25                                                      
CONECT   49   26                                                      
CONECT   50   28                                                      
CONECT   51   29                                                      
CONECT   52   31                                                      
CONECT   53   31                                                      
CONECT   54   31                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
