COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.873   1.807  -0.118  1.00  0.00           C  
HETATM    2  O   UNL     1       6.595   0.409  -0.014  1.00  0.00           O  
HETATM    3  C   UNL     1       5.287   0.039   0.009  1.00  0.00           C  
HETATM    4  C   UNL     1       4.948  -1.308   0.109  1.00  0.00           C  
HETATM    5  O   UNL     1       5.924  -2.252   0.184  1.00  0.00           O  
HETATM    6  C   UNL     1       5.503  -3.614   0.285  1.00  0.00           C  
HETATM    7  C   UNL     1       4.297   1.001  -0.062  1.00  0.00           C  
HETATM    8  C   UNL     1       2.952   0.621  -0.039  1.00  0.00           C  
HETATM    9  C   UNL     1       2.624  -0.731   0.056  1.00  0.00           C  
HETATM   10  C   UNL     1       3.613  -1.687   0.132  1.00  0.00           C  
HETATM   11  C   UNL     1       1.710   1.422  -0.098  1.00  0.00           C  
HETATM   12  N   UNL     1       1.248   2.706  -0.190  1.00  0.00           N  
HETATM   13  N   UNL     1      -0.152   2.663  -0.190  1.00  0.00           N  
HETATM   14  C   UNL     1      -0.530   1.404  -0.101  1.00  0.00           C  
HETATM   15  C   UNL     1       0.623   0.604  -0.043  1.00  0.00           C  
HETATM   16  C   UNL     1       1.117  -0.819   0.059  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.930   0.917  -0.070  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.916   1.668   0.569  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.216   1.216   0.599  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.548   0.005  -0.011  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.561  -0.747  -0.650  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.262  -0.290  -0.684  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.944  -0.482   0.022  1.00  0.00           C  
HETATM   24  N   UNL     1      -6.410  -1.632  -0.525  1.00  0.00           N  
HETATM   25  N   UNL     1      -7.785  -1.649  -0.232  1.00  0.00           N  
HETATM   26  N   UNL     1      -8.040  -0.573   0.430  1.00  0.00           N  
HETATM   27  N   UNL     1      -6.969   0.117   0.591  1.00  0.00           N  
HETATM   28  H   UNL     1       6.443   2.195  -1.041  1.00  0.00           H  
HETATM   29  H   UNL     1       6.435   2.329   0.734  1.00  0.00           H  
HETATM   30  H   UNL     1       7.951   1.964  -0.125  1.00  0.00           H  
HETATM   31  H   UNL     1       4.901  -3.742   1.184  1.00  0.00           H  
HETATM   32  H   UNL     1       4.909  -3.876  -0.591  1.00  0.00           H  
HETATM   33  H   UNL     1       6.378  -4.261   0.337  1.00  0.00           H  
HETATM   34  H   UNL     1       4.563   2.046  -0.135  1.00  0.00           H  
HETATM   35  H   UNL     1       3.350  -2.731   0.209  1.00  0.00           H  
HETATM   36  H   UNL     1       1.793   3.506  -0.245  1.00  0.00           H  
HETATM   37  H   UNL     1       0.773  -1.399  -0.797  1.00  0.00           H  
HETATM   38  H   UNL     1       0.769  -1.273   0.987  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.659   2.605   1.041  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.979   1.798   1.095  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.816  -1.684  -1.122  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.499  -0.870  -1.183  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.903  -2.300  -1.012  1.00  0.00           H  
CONECT    1    2   28   29   30                                       
CONECT    2    1    3                                                 
CONECT    3    2    7    7    4                                       
CONECT    4    3    5   10   10                                       
CONECT    5    4    6                                                 
CONECT    6    5   31   32   33                                       
CONECT    7    3    3    8   34                                       
CONECT    8    7   11    9    9                                       
CONECT    9    8    8   10   16                                       
CONECT   10    4    4    9   35                                       
CONECT   11   12    8   15   15                                       
CONECT   12   11   13   36                                            
CONECT   13   12   14   14                                            
CONECT   14   13   13   15   17                                       
CONECT   15   11   11   14   16                                       
CONECT   16    9   15   37   38                                       
CONECT   17   14   18   18   22                                       
CONECT   18   17   17   19   39                                       
CONECT   19   18   20   20   40                                       
CONECT   20   19   19   21   23                                       
CONECT   21   22   22   20   41                                       
CONECT   22   17   21   21   42                                       
CONECT   23   20   24   27   27                                       
CONECT   24   23   25   43                                            
CONECT   25   24   26   26                                            
CONECT   26   27   25   25                                            
CONECT   27   23   23   26                                            
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    6                                                      
CONECT   32    6                                                      
CONECT   33    6                                                      
CONECT   34    7                                                      
CONECT   35   10                                                      
CONECT   36   12                                                      
CONECT   37   16                                                      
CONECT   38   16                                                      
CONECT   39   18                                                      
CONECT   40   19                                                      
CONECT   41   21                                                      
CONECT   42   22                                                      
CONECT   43   24                                                      
MASTER        0    0    0    0    0    0    0    0   43    0   43    0
END
