COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.505  -2.003  -0.044  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.246   0.915   0.178  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.487  -0.866   1.010  1.00  0.00           C  
HETATM    4  C   UNL     1       0.131  -2.084   1.212  1.00  0.00           C  
HETATM    5  C   UNL     1       1.501  -2.200   1.076  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.793   3.120  -0.308  1.00  0.00           C  
HETATM    7  C   UNL     1       5.744  -0.688  -0.546  1.00  0.00           C  
HETATM    8  C   UNL     1       2.265  -1.090   0.735  1.00  0.00           C  
HETATM    9  C   UNL     1       1.652   0.137   0.530  1.00  0.00           C  
HETATM   10  C   UNL     1       0.271   0.252   0.668  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.392   1.561   0.444  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.036   2.752   0.996  1.00  0.00           C  
HETATM   13  N   UNL     1      -0.895   3.703   0.536  1.00  0.00           N  
HETATM   14  C   UNL     1      -2.261   0.782  -1.203  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.753  -1.119  -1.040  1.00  0.00           C  
HETATM   16  N   UNL     1      -3.184   0.038  -0.336  1.00  0.00           N  
HETATM   17  C   UNL     1      -1.516   1.805  -0.385  1.00  0.00           C  
HETATM   18  O   UNL     1       3.698   0.331  -1.000  1.00  0.00           O  
HETATM   19  C   UNL     1       4.302  -0.487  -0.334  1.00  0.00           C  
HETATM   20  N   UNL     1       3.652  -1.210   0.599  1.00  0.00           N  
HETATM   21  N   UNL     1      -5.073  -3.160  -0.748  1.00  0.00           N  
HETATM   22  H   UNL     1      -3.817  -2.349   0.727  1.00  0.00           H  
HETATM   23  H   UNL     1      -5.308  -1.429   0.418  1.00  0.00           H  
HETATM   24  H   UNL     1      -4.809   1.331  -0.657  1.00  0.00           H  
HETATM   25  H   UNL     1      -4.915   0.339   0.817  1.00  0.00           H  
HETATM   26  H   UNL     1      -3.800   1.726   0.755  1.00  0.00           H  
HETATM   27  H   UNL     1      -1.559  -0.781   1.113  1.00  0.00           H  
HETATM   28  H   UNL     1      -0.459  -2.950   1.477  1.00  0.00           H  
HETATM   29  H   UNL     1       1.980  -3.154   1.236  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.595   3.627  -0.825  1.00  0.00           H  
HETATM   31  H   UNL     1       6.281  -1.414   0.046  1.00  0.00           H  
HETATM   32  H   UNL     1       2.243   1.001   0.265  1.00  0.00           H  
HETATM   33  H   UNL     1       0.784   2.915   1.679  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.872   4.644   0.771  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.550   0.090  -1.655  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.826   1.285  -1.988  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.950  -1.693  -1.501  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.441  -0.773  -1.811  1.00  0.00           H  
HETATM   39  H   UNL     1       4.145  -1.814   1.176  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.356  -3.673  -1.238  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.576  -3.760  -0.111  1.00  0.00           H  
HETATM   42  C   UNL     1       6.386   0.026  -1.467  1.00  0.00           C  
HETATM   43  H   UNL     1       7.445  -0.121  -1.622  1.00  0.00           H  
HETATM   44  H   UNL     1       5.849   0.752  -2.059  1.00  0.00           H  
CONECT    1   21   15   22   23                                       
CONECT    2   16   24   25   26                                       
CONECT    3    4    4   10   27                                       
CONECT    4    5    3    3   28                                       
CONECT    5    8    8    4   29                                       
CONECT    6   17   17   13   30                                       
CONECT    7   19   31   42   42                                       
CONECT    8   20    5    5    9                                       
CONECT    9    8   10   10   32                                       
CONECT   10    9    9    3   11                                       
CONECT   11   10   12   12   17                                       
CONECT   12   11   11   13   33                                       
CONECT   13   12    6   34                                            
CONECT   14   17   16   35   36                                       
CONECT   15    1   16   37   38                                       
CONECT   16   14    2   15                                            
CONECT   17   11   14    6    6                                       
CONECT   18   19   19                                                 
CONECT   19    7   18   18   20                                       
CONECT   20   19    8   39                                            
CONECT   21    1   40   41                                            
CONECT   22    1                                                      
CONECT   23    1                                                      
CONECT   24    2                                                      
CONECT   25    2                                                      
CONECT   26    2                                                      
CONECT   27    3                                                      
CONECT   28    4                                                      
CONECT   29    5                                                      
CONECT   30    6                                                      
CONECT   31    7                                                      
CONECT   32    9                                                      
CONECT   33   12                                                      
CONECT   34   13                                                      
CONECT   35   14                                                      
CONECT   36   14                                                      
CONECT   37   15                                                      
CONECT   38   15                                                      
CONECT   39   20                                                      
CONECT   40   21                                                      
CONECT   41   21                                                      
CONECT   42    7    7   43   44                                       
CONECT   43   42                                                      
CONECT   44   42                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
