COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.926  -0.935  -1.504  1.00  0.00           C  
HETATM    2  N   UNL     1       4.214  -1.483  -0.341  1.00  0.00           N  
HETATM    3  C   UNL     1       5.061  -2.431   0.395  1.00  0.00           C  
HETATM    4  C   UNL     1       3.739  -0.408   0.540  1.00  0.00           C  
HETATM    5  C   UNL     1       2.671   0.413  -0.187  1.00  0.00           C  
HETATM    6  O   UNL     1       1.503  -0.394  -0.410  1.00  0.00           O  
HETATM    7  C   UNL     1       0.360   0.483  -0.308  1.00  0.00           C  
HETATM    8  N   UNL     1      -0.854  -0.284  -0.015  1.00  0.00           N  
HETATM    9  C   UNL     1      -2.142   0.101  -0.285  1.00  0.00           C  
HETATM   10  N   UNL     1      -2.706   1.170  -0.840  1.00  0.00           N  
HETATM   11  C   UNL     1      -4.013   1.250  -0.964  1.00  0.00           C  
HETATM   12  N   UNL     1      -4.825   0.293  -0.552  1.00  0.00           N  
HETATM   13  C   UNL     1      -4.353  -0.812   0.014  1.00  0.00           C  
HETATM   14  N   UNL     1      -5.212  -1.810   0.442  1.00  0.00           N  
HETATM   15  C   UNL     1      -2.963  -0.945   0.168  1.00  0.00           C  
HETATM   16  N   UNL     1      -2.148  -1.897   0.683  1.00  0.00           N  
HETATM   17  C   UNL     1      -0.909  -1.513   0.572  1.00  0.00           C  
HETATM   18  C   UNL     1       0.720   1.410   0.880  1.00  0.00           C  
HETATM   19  O   UNL     1       0.028   2.657   0.782  1.00  0.00           O  
HETATM   20  C   UNL     1       2.243   1.607   0.688  1.00  0.00           C  
HETATM   21  O   UNL     1       2.507   2.840   0.014  1.00  0.00           O  
HETATM   22  H   UNL     1       5.785  -0.356  -1.164  1.00  0.00           H  
HETATM   23  H   UNL     1       5.266  -1.753  -2.139  1.00  0.00           H  
HETATM   24  H   UNL     1       4.254  -0.290  -2.070  1.00  0.00           H  
HETATM   25  H   UNL     1       5.924  -1.906   0.803  1.00  0.00           H  
HETATM   26  H   UNL     1       4.487  -2.874   1.209  1.00  0.00           H  
HETATM   27  H   UNL     1       5.398  -3.217  -0.280  1.00  0.00           H  
HETATM   28  H   UNL     1       3.311  -0.841   1.444  1.00  0.00           H  
HETATM   29  H   UNL     1       4.575   0.239   0.807  1.00  0.00           H  
HETATM   30  H   UNL     1       3.063   0.769  -1.140  1.00  0.00           H  
HETATM   31  H   UNL     1       0.236   1.059  -1.225  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.439   2.133  -1.419  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.169  -1.707   0.330  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.855  -2.613   0.854  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.052  -2.083   0.898  1.00  0.00           H  
HETATM   36  H   UNL     1       0.508   0.923   1.832  1.00  0.00           H  
HETATM   37  H   UNL     1       0.221   3.271   1.503  1.00  0.00           H  
HETATM   38  H   UNL     1       2.758   1.581   1.648  1.00  0.00           H  
HETATM   39  H   UNL     1       2.257   3.626   0.519  1.00  0.00           H  
CONECT    1    2   22   23   24                                       
CONECT    2    3    1    4                                            
CONECT    3    2   25   26   27                                       
CONECT    4    2    5   28   29                                       
CONECT    5    4    6   20   30                                       
CONECT    6    5    7                                                 
CONECT    7    6    8   18   31                                       
CONECT    8    7    9   17                                            
CONECT    9   10    8   15   15                                       
CONECT   10   11   11    9                                            
CONECT   11   10   10   12   32                                       
CONECT   12   11   13   13                                            
CONECT   13   12   12   15   14                                       
CONECT   14   13   33   34                                            
CONECT   15    9    9   13   16                                       
CONECT   16   17   17   15                                            
CONECT   17    8   16   16   35                                       
CONECT   18   20    7   19   36                                       
CONECT   19   18   37                                                 
CONECT   20    5   21   18   38                                       
CONECT   21   20   39                                                 
CONECT   22    1                                                      
CONECT   23    1                                                      
CONECT   24    1                                                      
CONECT   25    3                                                      
CONECT   26    3                                                      
CONECT   27    3                                                      
CONECT   28    4                                                      
CONECT   29    4                                                      
CONECT   30    5                                                      
CONECT   31    7                                                      
CONECT   32   11                                                      
CONECT   33   14                                                      
CONECT   34   14                                                      
CONECT   35   17                                                      
CONECT   36   18                                                      
CONECT   37   19                                                      
CONECT   38   20                                                      
CONECT   39   21                                                      
MASTER        0    0    0    0    0    0    0    0   39    0   39    0
END
