COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -7.916  -1.443   0.187  1.00  0.00           O  
HETATM    2  C   UNL     1      -7.192  -0.467   0.151  1.00  0.00           C  
HETATM    3  N   UNL     1      -7.724   0.770   0.201  1.00  0.00           N  
HETATM    4  C   UNL     1      -9.176   0.939   0.300  1.00  0.00           C  
HETATM    5  C   UNL     1      -9.502   2.374   0.339  1.00  0.00           C  
HETATM    6  N   UNL     1      -9.753   3.481   0.369  1.00  0.00           N  
HETATM    7  C   UNL     1      -5.726  -0.638   0.058  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.893   0.483   0.022  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.528   0.323  -0.065  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.977  -0.958  -0.117  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.808  -2.077  -0.082  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.173  -1.919   0.012  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.507  -1.129  -0.212  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.944  -2.406  -0.265  1.00  0.00           C  
HETATM   15  C   UNL     1       0.434  -2.516  -0.352  1.00  0.00           C  
HETATM   16  N   UNL     1       1.170  -1.417  -0.382  1.00  0.00           N  
HETATM   17  C   UNL     1       0.608  -0.218  -0.330  1.00  0.00           C  
HETATM   18  N   UNL     1      -0.705  -0.067  -0.252  1.00  0.00           N  
HETATM   19  N   UNL     1       1.415   0.907  -0.364  1.00  0.00           N  
HETATM   20  C   UNL     1       2.809   0.771  -0.336  1.00  0.00           C  
HETATM   21  C   UNL     1       3.609   1.671  -1.027  1.00  0.00           C  
HETATM   22  C   UNL     1       4.983   1.537  -0.999  1.00  0.00           C  
HETATM   23  C   UNL     1       5.565   0.501  -0.280  1.00  0.00           C  
HETATM   24  C   UNL     1       4.765  -0.399   0.411  1.00  0.00           C  
HETATM   25  C   UNL     1       3.391  -0.262   0.387  1.00  0.00           C  
HETATM   26  N   UNL     1       6.957   0.364  -0.252  1.00  0.00           N  
HETATM   27  C   UNL     1       7.357  -0.792   0.563  1.00  0.00           C  
HETATM   28  C   UNL     1       8.880  -0.940   0.518  1.00  0.00           C  
HETATM   29  O   UNL     1       9.485   0.275   0.968  1.00  0.00           O  
HETATM   30  C   UNL     1       9.118   1.422   0.195  1.00  0.00           C  
HETATM   31  C   UNL     1       7.598   1.593   0.238  1.00  0.00           C  
HETATM   32  H   UNL     1      -7.146   1.548   0.172  1.00  0.00           H  
HETATM   33  H   UNL     1      -9.655   0.481  -0.566  1.00  0.00           H  
HETATM   34  H   UNL     1      -9.537   0.460   1.210  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.320   1.474   0.062  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.884   1.189  -0.093  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.381  -3.068  -0.123  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.817  -2.786   0.044  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.568  -3.287  -0.238  1.00  0.00           H  
HETATM   40  H   UNL     1       0.902  -3.488  -0.395  1.00  0.00           H  
HETATM   41  H   UNL     1       1.015   1.790  -0.408  1.00  0.00           H  
HETATM   42  H   UNL     1       3.157   2.477  -1.586  1.00  0.00           H  
HETATM   43  H   UNL     1       5.605   2.237  -1.537  1.00  0.00           H  
HETATM   44  H   UNL     1       5.217  -1.202   0.974  1.00  0.00           H  
HETATM   45  H   UNL     1       2.769  -0.962   0.925  1.00  0.00           H  
HETATM   46  H   UNL     1       7.037  -0.639   1.594  1.00  0.00           H  
HETATM   47  H   UNL     1       6.892  -1.695   0.168  1.00  0.00           H  
HETATM   48  H   UNL     1       9.186  -1.760   1.167  1.00  0.00           H  
HETATM   49  H   UNL     1       9.195  -1.147  -0.505  1.00  0.00           H  
HETATM   50  H   UNL     1       9.597   2.309   0.611  1.00  0.00           H  
HETATM   51  H   UNL     1       9.441   1.284  -0.837  1.00  0.00           H  
HETATM   52  H   UNL     1       7.308   2.432  -0.396  1.00  0.00           H  
HETATM   53  H   UNL     1       7.281   1.785   1.263  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    7                                       
CONECT    3    4    2   32                                            
CONECT    4    5    3   33   34                                       
CONECT    5    6    6    6    4                                       
CONECT    6    5    5    5                                            
CONECT    7    2   12   12    8                                       
CONECT    8    7    9    9   35                                       
CONECT    9    8    8   10   36                                       
CONECT   10   11   11    9   13                                       
CONECT   11   12   10   10   37                                       
CONECT   12    7    7   11   38                                       
CONECT   13   10   14   14   18                                       
CONECT   14   13   13   15   39                                       
CONECT   15   14   16   16   40                                       
CONECT   16   15   15   17                                            
CONECT   17   18   18   16   19                                       
CONECT   18   13   17   17                                            
CONECT   19   17   20   41                                            
CONECT   20   25   19   21   21                                       
CONECT   21   20   20   22   42                                       
CONECT   22   23   23   21   43                                       
CONECT   23   24   26   22   22                                       
CONECT   24   25   25   23   44                                       
CONECT   25   24   24   20   45                                       
CONECT   26   31   23   27                                            
CONECT   27   26   28   46   47                                       
CONECT   28   29   27   48   49                                       
CONECT   29   30   28                                                 
CONECT   30   31   29   50   51                                       
CONECT   31   30   26   52   53                                       
CONECT   32    3                                                      
CONECT   33    4                                                      
CONECT   34    4                                                      
CONECT   35    8                                                      
CONECT   36    9                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   14                                                      
CONECT   40   15                                                      
CONECT   41   19                                                      
CONECT   42   21                                                      
CONECT   43   22                                                      
CONECT   44   24                                                      
CONECT   45   25                                                      
CONECT   46   27                                                      
CONECT   47   27                                                      
CONECT   48   28                                                      
CONECT   49   28                                                      
CONECT   50   30                                                      
CONECT   51   30                                                      
CONECT   52   31                                                      
CONECT   53   31                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
