COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       1.857   3.764   0.608  1.00  0.00           N  
HETATM    2  C   UNL     1       0.511   3.565   0.358  1.00  0.00           C  
HETATM    3  C   UNL     1       0.034   2.310  -0.043  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.342   2.156  -0.285  1.00  0.00           C  
HETATM    5  N   UNL     1      -1.550   0.853  -0.659  1.00  0.00           N  
HETATM    6  C   UNL     1      -2.789   0.305  -0.986  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.818   0.474  -0.179  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.158  -0.119  -0.532  1.00  0.00           C  
HETATM    9  O   UNL     1      -5.720  -0.749   0.621  1.00  0.00           O  
HETATM   10  C   UNL     1      -0.364   0.168  -0.666  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.203  -1.286  -1.026  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.204  -2.131   0.250  1.00  0.00           C  
HETATM   13  C   UNL     1       0.094  -3.567  -0.098  1.00  0.00           C  
HETATM   14  O   UNL     1       0.144  -4.496   0.869  1.00  0.00           O  
HETATM   15  C   UNL     1       0.435  -5.858   0.461  1.00  0.00           C  
HETATM   16  O   UNL     1       0.287  -3.882  -1.249  1.00  0.00           O  
HETATM   17  C   UNL     1      -1.526  -2.046   0.893  1.00  0.00           C  
HETATM   18  N   UNL     1      -2.545  -1.981   1.389  1.00  0.00           N  
HETATM   19  C   UNL     1       0.644   0.998  -0.299  1.00  0.00           C  
HETATM   20  C   UNL     1       2.080   0.651  -0.180  1.00  0.00           C  
HETATM   21  C   UNL     1       2.828   0.366  -1.322  1.00  0.00           C  
HETATM   22  C   UNL     1       4.164   0.043  -1.205  1.00  0.00           C  
HETATM   23  C   UNL     1       4.762   0.002   0.042  1.00  0.00           C  
HETATM   24  C   UNL     1       6.222  -0.351   0.163  1.00  0.00           C  
HETATM   25  C   UNL     1       4.025   0.284   1.178  1.00  0.00           C  
HETATM   26  C   UNL     1       2.689   0.613   1.074  1.00  0.00           C  
HETATM   27  N   UNL     1      -2.138   3.212  -0.123  1.00  0.00           N  
HETATM   28  C   UNL     1      -1.647   4.372   0.255  1.00  0.00           C  
HETATM   29  N   UNL     1      -0.362   4.558   0.498  1.00  0.00           N  
HETATM   30  H   UNL     1       2.483   3.030   0.507  1.00  0.00           H  
HETATM   31  H   UNL     1       2.176   4.638   0.881  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.906  -0.258  -1.900  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.701   1.036   0.735  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.826   0.671  -0.876  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.031  -0.857  -1.324  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.584  -1.153   0.466  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.028  -1.595  -1.668  1.00  0.00           H  
HETATM   38  H   UNL     1       0.740  -1.428  -1.554  1.00  0.00           H  
HETATM   39  H   UNL     1       0.558  -1.758   0.934  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.330  -6.201  -0.234  1.00  0.00           H  
HETATM   41  H   UNL     1       1.410  -5.891  -0.026  1.00  0.00           H  
HETATM   42  H   UNL     1       0.446  -6.506   1.338  1.00  0.00           H  
HETATM   43  H   UNL     1       2.362   0.396  -2.295  1.00  0.00           H  
HETATM   44  H   UNL     1       4.745  -0.178  -2.088  1.00  0.00           H  
HETATM   45  H   UNL     1       6.822   0.558   0.106  1.00  0.00           H  
HETATM   46  H   UNL     1       6.399  -0.843   1.119  1.00  0.00           H  
HETATM   47  H   UNL     1       6.502  -1.022  -0.649  1.00  0.00           H  
HETATM   48  H   UNL     1       4.498   0.251   2.149  1.00  0.00           H  
HETATM   49  H   UNL     1       2.116   0.838   1.961  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.323   5.206   0.376  1.00  0.00           H  
CONECT    1    2   30   31                                            
CONECT    2   29   29    3    1                                       
CONECT    3    4    4    2   19                                       
CONECT    4   27    5    3    3                                       
CONECT    5    6    4   10                                            
CONECT    6    7    7    5   32                                       
CONECT    7    8    6    6   33                                       
CONECT    8    9    7   34   35                                       
CONECT    9    8   36                                                 
CONECT   10    5   11   19   19                                       
CONECT   11   10   12   37   38                                       
CONECT   12   17   11   13   39                                       
CONECT   13   12   14   16   16                                       
CONECT   14   13   15                                                 
CONECT   15   14   40   41   42                                       
CONECT   16   13   13                                                 
CONECT   17   18   18   18   12                                       
CONECT   18   17   17   17                                            
CONECT   19   10   10    3   20                                       
CONECT   20   19   26   26   21                                       
CONECT   21   20   22   22   43                                       
CONECT   22   21   21   23   44                                       
CONECT   23   25   25   22   24                                       
CONECT   24   23   45   46   47                                       
CONECT   25   26   23   23   48                                       
CONECT   26   20   20   25   49                                       
CONECT   27   28   28    4                                            
CONECT   28   27   27   29   50                                       
CONECT   29   28    2    2                                            
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    6                                                      
CONECT   33    7                                                      
CONECT   34    8                                                      
CONECT   35    8                                                      
CONECT   36    9                                                      
CONECT   37   11                                                      
CONECT   38   11                                                      
CONECT   39   12                                                      
CONECT   40   15                                                      
CONECT   41   15                                                      
CONECT   42   15                                                      
CONECT   43   21                                                      
CONECT   44   22                                                      
CONECT   45   24                                                      
CONECT   46   24                                                      
CONECT   47   24                                                      
CONECT   48   25                                                      
CONECT   49   26                                                      
CONECT   50   28                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
