COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.065  -1.154   4.345  1.00  0.00           C  
HETATM    2  C   UNL     1       2.042   0.065   4.286  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.846   1.542   0.225  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.923   2.390  -2.057  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.984   1.421  -0.938  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.531  -1.987   2.484  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.711  -0.984   2.994  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.486   0.160   2.264  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.085   0.316   1.011  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.912  -0.690   0.503  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.133  -1.832   1.238  1.00  0.00           C  
HETATM   12  N   UNL     1      -1.756  -3.142   3.224  1.00  0.00           N  
HETATM   13  N   UNL     1       0.745   0.026   4.650  1.00  0.00           N  
HETATM   14  C   UNL     1       0.147   1.165   5.352  1.00  0.00           C  
HETATM   15  O   UNL     1       2.537  -0.877   3.705  1.00  0.00           O  
HETATM   16  C   UNL     1       2.877   1.280   4.600  1.00  0.00           C  
HETATM   17  N   UNL     1      -1.564   1.777  -0.890  1.00  0.00           N  
HETATM   18  O   UNL     1      -0.002   2.340   0.585  1.00  0.00           O  
HETATM   19  C   UNL     1      -0.358   1.311  -2.944  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.000   0.752  -3.982  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.094  -0.242  -4.561  1.00  0.00           C  
HETATM   22  C   UNL     1       1.078  -0.198  -3.785  1.00  0.00           C  
HETATM   23  N   UNL     1       0.887   0.760  -2.815  1.00  0.00           N  
HETATM   24  C   UNL     1       1.870   1.132  -1.794  1.00  0.00           C  
HETATM   25  C   UNL     1      -0.185  -1.129  -5.635  1.00  0.00           C  
HETATM   26  C   UNL     1       0.866  -1.951  -5.927  1.00  0.00           C  
HETATM   27  C   UNL     1       2.136  -1.043  -4.100  1.00  0.00           C  
HETATM   28  C   UNL     1       2.024  -1.911  -5.165  1.00  0.00           C  
HETATM   29  H   UNL     1       0.570  -2.039   4.335  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.838  -1.270   5.105  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.660   2.969  -2.614  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.119   3.047  -1.727  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.277   0.972   0.010  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.578   2.317  -1.115  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.153   0.708  -1.745  1.00  0.00           H  
HETATM   36  H   UNL     1       0.152   0.936   2.658  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.377  -0.571  -0.463  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.772  -2.610   0.847  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.332  -3.839   2.873  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.337  -3.252   4.092  1.00  0.00           H  
HETATM   41  H   UNL     1       0.898   1.942   5.489  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.680   1.559   4.764  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.220   0.839   6.325  1.00  0.00           H  
HETATM   44  H   UNL     1       3.891   1.129   4.231  1.00  0.00           H  
HETATM   45  H   UNL     1       2.441   2.155   4.117  1.00  0.00           H  
HETATM   46  H   UNL     1       2.902   1.434   5.678  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.996   0.990  -4.325  1.00  0.00           H  
HETATM   48  H   UNL     1       2.433   2.002  -2.132  1.00  0.00           H  
HETATM   49  H   UNL     1       1.355   1.372  -0.864  1.00  0.00           H  
HETATM   50  H   UNL     1       2.553   0.299  -1.627  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.084  -1.165  -6.233  1.00  0.00           H  
HETATM   52  H   UNL     1       0.794  -2.637  -6.758  1.00  0.00           H  
HETATM   53  H   UNL     1       3.042  -1.020  -3.513  1.00  0.00           H  
HETATM   54  H   UNL     1       2.847  -2.568  -5.408  1.00  0.00           H  
CONECT    1    7   13   29   30                                       
CONECT    2   13   15   15   16                                       
CONECT    3    9   17   18   18                                       
CONECT    4   17   19   31   32                                       
CONECT    5   17   33   34   35                                       
CONECT    6    7    7   11   12                                       
CONECT    7    1    6    6    8                                       
CONECT    8    7    9    9   36                                       
CONECT    9    3    8    8   10                                       
CONECT   10    9   11   11   37                                       
CONECT   11    6   10   10   38                                       
CONECT   12    6   39   40                                            
CONECT   13    1    2   14                                            
CONECT   14   13   41   42   43                                       
CONECT   15    2    2                                                 
CONECT   16    2   44   45   46                                       
CONECT   17    3    4    5                                            
CONECT   18    3    3                                                 
CONECT   19    4   20   20   23                                       
CONECT   20   19   19   21   47                                       
CONECT   21   20   22   22   25                                       
CONECT   22   21   21   23   27                                       
CONECT   23   19   22   24                                            
CONECT   24   23   48   49   50                                       
CONECT   25   21   26   26   51                                       
CONECT   26   25   25   28   52                                       
CONECT   27   22   28   28   53                                       
CONECT   28   26   27   27   54                                       
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    4                                                      
CONECT   32    4                                                      
CONECT   33    5                                                      
CONECT   34    5                                                      
CONECT   35    5                                                      
CONECT   36    8                                                      
CONECT   37   10                                                      
CONECT   38   11                                                      
CONECT   39   12                                                      
CONECT   40   12                                                      
CONECT   41   14                                                      
CONECT   42   14                                                      
CONECT   43   14                                                      
CONECT   44   16                                                      
CONECT   45   16                                                      
CONECT   46   16                                                      
CONECT   47   20                                                      
CONECT   48   24                                                      
CONECT   49   24                                                      
CONECT   50   24                                                      
CONECT   51   25                                                      
CONECT   52   26                                                      
CONECT   53   27                                                      
CONECT   54   28                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
