COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.797  -0.665   1.035  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.050  -0.341   0.538  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.170   0.559  -0.510  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.036   1.137  -1.061  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.781   0.813  -0.563  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.662  -0.089   0.486  1.00  0.00           C  
HETATM    7  O   UNL     1      -2.681  -1.544   2.066  1.00  0.00           O  
HETATM    8  C   UNL     1      -3.892  -2.095   2.587  1.00  0.00           C  
HETATM    9  O   UNL     1      -5.398   0.875  -0.998  1.00  0.00           O  
HETATM   10  C   UNL     1      -6.523   0.243  -0.383  1.00  0.00           C  
HETATM   11  N   UNL     1      -0.638   1.395  -1.118  1.00  0.00           N  
HETATM   12  C   UNL     1       0.609   1.065  -0.632  1.00  0.00           C  
HETATM   13  N   UNL     1       1.022  -0.204  -0.655  1.00  0.00           N  
HETATM   14  C   UNL     1       2.198  -0.577  -0.206  1.00  0.00           C  
HETATM   15  N   UNL     1       3.089   0.312   0.321  1.00  0.00           N  
HETATM   16  C   UNL     1       2.762   1.648   0.392  1.00  0.00           C  
HETATM   17  C   UNL     1       1.451   2.064  -0.115  1.00  0.00           C  
HETATM   18  C   UNL     1       1.033   3.465  -0.080  1.00  0.00           C  
HETATM   19  O   UNL     1      -0.022   3.799  -0.589  1.00  0.00           O  
HETATM   20  N   UNL     1       1.815   4.387   0.516  1.00  0.00           N  
HETATM   21  N   UNL     1       3.785   2.267   0.933  1.00  0.00           N  
HETATM   22  N   UNL     1       4.714   1.417   1.200  1.00  0.00           N  
HETATM   23  C   UNL     1       4.345   0.214   0.848  1.00  0.00           C  
HETATM   24  N   UNL     1       2.542  -1.900  -0.268  1.00  0.00           N  
HETATM   25  C   UNL     1       1.660  -2.855  -0.944  1.00  0.00           C  
HETATM   26  C   UNL     1       2.298  -4.245  -0.917  1.00  0.00           C  
HETATM   27  C   UNL     1       0.310  -2.899  -0.225  1.00  0.00           C  
HETATM   28  C   UNL     1       1.451  -2.417  -2.395  1.00  0.00           C  
HETATM   29  N   UNL     1       2.499  -4.666   0.476  1.00  0.00           N  
HETATM   30  H   UNL     1      -4.934  -0.791   0.966  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.129   1.838  -1.878  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.687  -0.341   0.873  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.528  -1.290   2.958  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.415  -2.636   1.798  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.658  -2.778   3.403  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.435  -0.839  -0.490  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.552   0.502   0.675  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.439   0.582  -0.866  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.721   2.031  -1.846  1.00  0.00           H  
HETATM   40  H   UNL     1       2.655   4.121   0.922  1.00  0.00           H  
HETATM   41  H   UNL     1       1.538   5.316   0.540  1.00  0.00           H  
HETATM   42  H   UNL     1       4.924  -0.690   0.956  1.00  0.00           H  
HETATM   43  H   UNL     1       3.369  -2.206   0.136  1.00  0.00           H  
HETATM   44  H   UNL     1       1.642  -4.956  -1.420  1.00  0.00           H  
HETATM   45  H   UNL     1       3.260  -4.214  -1.429  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.208  -1.951  -0.366  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.294  -3.708  -0.637  1.00  0.00           H  
HETATM   48  H   UNL     1       0.470  -3.071   0.839  1.00  0.00           H  
HETATM   49  H   UNL     1       2.401  -2.462  -2.928  1.00  0.00           H  
HETATM   50  H   UNL     1       0.733  -3.082  -2.875  1.00  0.00           H  
HETATM   51  H   UNL     1       1.071  -1.396  -2.415  1.00  0.00           H  
HETATM   52  H   UNL     1       1.630  -4.641   0.990  1.00  0.00           H  
HETATM   53  H   UNL     1       2.919  -5.582   0.521  1.00  0.00           H  
CONECT    1    2    2    6    7                                       
CONECT    2    1    1    3   30                                       
CONECT    3    2    4    4    9                                       
CONECT    4    3    3    5   31                                       
CONECT    5    4    6    6   11                                       
CONECT    6    1    5    5   32                                       
CONECT    7    1    8                                                 
CONECT    8    7   33   34   35                                       
CONECT    9    3   10                                                 
CONECT   10    9   36   37   38                                       
CONECT   11    5   12   39                                            
CONECT   12   11   13   17   17                                       
CONECT   13   12   14   14                                            
CONECT   14   13   13   15   24                                       
CONECT   15   14   16   23                                            
CONECT   16   15   17   21   21                                       
CONECT   17   12   12   16   18                                       
CONECT   18   17   19   19   20                                       
CONECT   19   18   18                                                 
CONECT   20   18   40   41                                            
CONECT   21   16   16   22                                            
CONECT   22   21   23   23                                            
CONECT   23   15   22   22   42                                       
CONECT   24   14   25   43                                            
CONECT   25   24   26   27   28                                       
CONECT   26   25   29   44   45                                       
CONECT   27   25   46   47   48                                       
CONECT   28   25   49   50   51                                       
CONECT   29   26   52   53                                            
CONECT   30    2                                                      
CONECT   31    4                                                      
CONECT   32    6                                                      
CONECT   33    8                                                      
CONECT   34    8                                                      
CONECT   35    8                                                      
CONECT   36   10                                                      
CONECT   37   10                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   20                                                      
CONECT   41   20                                                      
CONECT   42   23                                                      
CONECT   43   24                                                      
CONECT   44   26                                                      
CONECT   45   26                                                      
CONECT   46   27                                                      
CONECT   47   27                                                      
CONECT   48   27                                                      
CONECT   49   28                                                      
CONECT   50   28                                                      
CONECT   51   28                                                      
CONECT   52   29                                                      
CONECT   53   29                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
