COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.597  -1.699   1.213  1.00  0.00           C  
HETATM    2  N   UNL     1       3.629   0.297   0.016  1.00  0.00           N  
HETATM    3  O   UNL     1       6.399   0.131  -0.177  1.00  0.00           O  
HETATM    4  C   UNL     1       5.647  -1.064  -0.178  1.00  0.00           C  
HETATM    5  N   UNL     1      -0.306   0.771  -0.977  1.00  0.00           N  
HETATM    6  O   UNL     1      -5.401   0.741   0.190  1.00  0.00           O  
HETATM    7  C   UNL     1       4.226  -0.843  -0.697  1.00  0.00           C  
HETATM    8  N   UNL     1       1.847   1.581  -0.845  1.00  0.00           N  
HETATM    9  C   UNL     1       4.386   1.517  -0.298  1.00  0.00           C  
HETATM   10  N   UNL     1      -0.698  -2.760  -0.184  1.00  0.00           N  
HETATM   11  C   UNL     1       5.827   1.369   0.185  1.00  0.00           C  
HETATM   12  N   UNL     1      -1.888  -3.464   0.023  1.00  0.00           N  
HETATM   13  C   UNL     1       5.889   1.592   1.699  1.00  0.00           C  
HETATM   14  C   UNL     1       2.291   0.443  -0.316  1.00  0.00           C  
HETATM   15  C   UNL     1       1.391  -0.598  -0.099  1.00  0.00           C  
HETATM   16  C   UNL     1       0.057  -0.400  -0.451  1.00  0.00           C  
HETATM   17  C   UNL     1       0.577   1.730  -1.165  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.943  -1.473  -0.243  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.933  -2.575   0.098  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.305  -2.721   0.290  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.112  -1.620   0.318  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.580  -0.342   0.158  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.781   2.027   0.131  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.364   2.495  -1.265  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.265   3.092   1.117  1.00  0.00           C  
HETATM   26  C   UNL     1      -3.895   2.440   1.308  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.224  -0.171  -0.032  1.00  0.00           C  
HETATM   28  C   UNL     1      -2.387  -1.289  -0.065  1.00  0.00           C  
HETATM   29  H   UNL     1       5.137  -1.002   1.914  1.00  0.00           H  
HETATM   30  H   UNL     1       5.010  -2.616   1.174  1.00  0.00           H  
HETATM   31  H   UNL     1       6.610  -1.930   1.543  1.00  0.00           H  
HETATM   32  H   UNL     1       6.140  -1.785  -0.854  1.00  0.00           H  
HETATM   33  H   UNL     1       3.627  -1.736  -0.518  1.00  0.00           H  
HETATM   34  H   UNL     1       4.253  -0.630  -1.765  1.00  0.00           H  
HETATM   35  H   UNL     1       4.377   1.680  -1.377  1.00  0.00           H  
HETATM   36  H   UNL     1       3.919   2.371   0.197  1.00  0.00           H  
HETATM   37  H   UNL     1       6.420   2.175  -0.287  1.00  0.00           H  
HETATM   38  H   UNL     1       6.930   1.584   2.025  1.00  0.00           H  
HETATM   39  H   UNL     1       5.439   2.555   1.943  1.00  0.00           H  
HETATM   40  H   UNL     1       5.344   0.797   2.207  1.00  0.00           H  
HETATM   41  H   UNL     1       1.719  -1.534   0.329  1.00  0.00           H  
HETATM   42  H   UNL     1       0.251   2.666  -1.593  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.730  -3.705   0.416  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.175  -1.741   0.466  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.338   2.182  -1.462  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.027   2.053  -2.010  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.429   3.581  -1.319  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.287   4.126   0.771  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.057   2.811   1.811  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.785   1.730   2.128  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.014   3.044   1.088  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.813   0.821  -0.155  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.965  -4.427   0.101  1.00  0.00           H  
CONECT    1    4   29   30   31                                       
CONECT    2   14    7    9                                            
CONECT    3    4   11                                                 
CONECT    4    7    1    3   32                                       
CONECT    5   17   17   16                                            
CONECT    6   23   22                                                 
CONECT    7    2    4   33   34                                       
CONECT    8   17   14   14                                            
CONECT    9    2   11   35   36                                       
CONECT   10   18   18   12                                            
CONECT   11    9    3   13   37                                       
CONECT   12   19   10   53                                            
CONECT   13   11   38   39   40                                       
CONECT   14    8    8   15    2                                       
CONECT   15   16   16   14   41                                       
CONECT   16    5   18   15   15                                       
CONECT   17    5    5    8   42                                       
CONECT   18   28   16   10   10                                       
CONECT   19   28   28   20   12                                       
CONECT   20   21   21   19   43                                       
CONECT   21   22   20   20   44                                       
CONECT   22    6   27   27   21                                       
CONECT   23   24   25   26    6                                       
CONECT   24   23   45   46   47                                       
CONECT   25   23   26   48   49                                       
CONECT   26   25   23   50   51                                       
CONECT   27   22   22   28   52                                       
CONECT   28   27   19   19   18                                       
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    4                                                      
CONECT   33    7                                                      
CONECT   34    7                                                      
CONECT   35    9                                                      
CONECT   36    9                                                      
CONECT   37   11                                                      
CONECT   38   13                                                      
CONECT   39   13                                                      
CONECT   40   13                                                      
CONECT   41   15                                                      
CONECT   42   17                                                      
CONECT   43   20                                                      
CONECT   44   21                                                      
CONECT   45   24                                                      
CONECT   46   24                                                      
CONECT   47   24                                                      
CONECT   48   25                                                      
CONECT   49   25                                                      
CONECT   50   26                                                      
CONECT   51   26                                                      
CONECT   52   27                                                      
CONECT   53   12                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
