COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.375   0.910   0.046  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.371   2.979   0.231  1.00  0.00           C  
HETATM    3  C   UNL     1       0.876   2.375   0.155  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.858   0.737   0.064  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.009  -0.067   0.002  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.865  -1.470  -0.136  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.018  -2.272  -0.197  1.00  0.00           C  
HETATM    8  C   UNL     1      -7.248  -1.694  -0.124  1.00  0.00           C  
HETATM    9  C   UNL     1      -7.388  -0.314   0.011  1.00  0.00           C  
HETATM   10  C   UNL     1      -6.295   0.495   0.074  1.00  0.00           C  
HETATM   11  C   UNL     1       2.232   0.284  -0.078  1.00  0.00           C  
HETATM   12  C   UNL     1       2.515  -0.950   0.432  1.00  0.00           C  
HETATM   13  C   UNL     1       4.347  -0.121  -0.579  1.00  0.00           C  
HETATM   14  C   UNL     1       6.635  -0.922  -0.112  1.00  0.00           C  
HETATM   15  C   UNL     1       5.774  -0.087  -1.064  1.00  0.00           C  
HETATM   16  C   UNL     1       1.861   4.530   0.349  1.00  0.00           C  
HETATM   17  C   UNL     1       3.853  -1.219   0.119  1.00  0.00           C  
HETATM   18  C   UNL     1       4.714  -2.381   0.403  1.00  0.00           C  
HETATM   19  O   UNL     1       4.255  -3.434   0.800  1.00  0.00           O  
HETATM   20  N   UNL     1       6.042  -2.216   0.199  1.00  0.00           N  
HETATM   21  N   UNL     1       3.364   0.772  -0.697  1.00  0.00           N  
HETATM   22  C   UNL     1       0.932   0.977   0.014  1.00  0.00           C  
HETATM   23  N   UNL     1      -0.207   0.289  -0.036  1.00  0.00           N  
HETATM   24  N   UNL     1      -1.459   2.228   0.174  1.00  0.00           N  
HETATM   25  C   UNL     1      -2.622   0.111  -0.014  1.00  0.00           C  
HETATM   26  N   UNL     1      -3.646  -2.016  -0.206  1.00  0.00           N  
HETATM   27  C   UNL     1      -2.561  -1.285  -0.150  1.00  0.00           C  
HETATM   28  O   UNL     1       2.013   3.115   0.211  1.00  0.00           O  
HETATM   29  H   UNL     1      -0.453   4.051   0.336  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.933   1.810   0.165  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.928  -3.343  -0.303  1.00  0.00           H  
HETATM   32  H   UNL     1      -8.130  -2.315  -0.172  1.00  0.00           H  
HETATM   33  H   UNL     1      -8.376   0.119   0.066  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.416   1.564   0.179  1.00  0.00           H  
HETATM   35  H   UNL     1       1.838  -1.595   0.973  1.00  0.00           H  
HETATM   36  H   UNL     1       7.609  -1.084  -0.573  1.00  0.00           H  
HETATM   37  H   UNL     1       5.834  -0.502  -2.070  1.00  0.00           H  
HETATM   38  H   UNL     1       6.130   0.943  -1.069  1.00  0.00           H  
HETATM   39  H   UNL     1       1.324   4.748   1.272  1.00  0.00           H  
HETATM   40  H   UNL     1       2.843   5.000   0.381  1.00  0.00           H  
HETATM   41  H   UNL     1       1.298   4.919  -0.499  1.00  0.00           H  
HETATM   42  H   UNL     1       3.434   1.630  -1.143  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.597  -1.767  -0.211  1.00  0.00           H  
HETATM   44  H   UNL     1       6.776  -0.368   0.816  1.00  0.00           H  
HETATM   45  H   UNL     1       6.622  -2.991   0.261  1.00  0.00           H  
CONECT    1   23   25   24   24                                       
CONECT    2    3    3   24   29                                       
CONECT    3   22   28    2    2                                       
CONECT    4    5    5   25   30                                       
CONECT    5   10    4    4    6                                       
CONECT    6    5    7   26   26                                       
CONECT    7    8    8    6   31                                       
CONECT    8    9    7    7   32                                       
CONECT    9   10   10    8   33                                       
CONECT   10    9    9    5   34                                       
CONECT   11   21   12   12   22                                       
CONECT   12   17   11   11   35                                       
CONECT   13   15   17   17   21                                       
CONECT   14   20   15   36   44                                       
CONECT   15   14   13   37   38                                       
CONECT   16   28   39   40   41                                       
CONECT   17   18   13   13   12                                       
CONECT   18   20   19   19   17                                       
CONECT   19   18   18                                                 
CONECT   20   14   18   45                                            
CONECT   21   13   11   42                                            
CONECT   22   11   23   23    3                                       
CONECT   23   22   22    1                                            
CONECT   24    1    1    2                                            
CONECT   25    4    1   27   27                                       
CONECT   26    6    6   27                                            
CONECT   27   25   25   26   43                                       
CONECT   28    3   16                                                 
CONECT   29    2                                                      
CONECT   30    4                                                      
CONECT   31    7                                                      
CONECT   32    8                                                      
CONECT   33    9                                                      
CONECT   34   10                                                      
CONECT   35   12                                                      
CONECT   36   14                                                      
CONECT   37   15                                                      
CONECT   38   15                                                      
CONECT   39   16                                                      
CONECT   40   16                                                      
CONECT   41   16                                                      
CONECT   42   21                                                      
CONECT   43   27                                                      
CONECT   44   14                                                      
CONECT   45   20                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
