COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.846   0.954   0.208  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.031  -0.417  -0.005  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.401  -0.985  -0.026  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.406  -0.773   0.939  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.920  -1.803  -0.988  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.929  -1.248  -0.197  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.467   0.645   0.034  1.00  0.00           C  
HETATM    8  CA  UNL     1       3.317   0.957  -0.112  1.00  0.00           C  
HETATM    9  C   UNL     1       3.667   1.495  -1.500  1.00  0.00           C  
HETATM   10  C   UNL     1       4.298  -0.121   0.272  1.00  0.00           C  
HETATM   11  C   UNL     1       5.349   0.172   1.121  1.00  0.00           C  
HETATM   12  C   UNL     1       6.249  -0.817   1.472  1.00  0.00           C  
HETATM   13  C   UNL     1       6.098  -2.098   0.975  1.00  0.00           C  
HETATM   14  O   UNL     1       1.064   2.397   0.238  1.00  0.00           O  
HETATM   15  C   UNL     1       0.899   1.207   0.054  1.00  0.00           C  
HETATM   16  N   UNL     1       1.962   0.400  -0.132  1.00  0.00           N  
HETATM   17  C   UNL     1       4.143  -1.403  -0.220  1.00  0.00           C  
HETATM   18  C   UNL     1       5.046  -2.391   0.127  1.00  0.00           C  
HETATM   19  O   UNL     1       3.718   0.412  -2.432  1.00  0.00           O  
HETATM   20  C   UNL     1      -1.569   1.481   0.227  1.00  0.00           C  
HETATM   21  O   UNL     1      -3.920   1.766   0.389  1.00  0.00           O  
HETATM   22  C   UNL     1      -3.656   3.154   0.600  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.657  -0.723  -0.177  1.00  0.00           C  
HETATM   24  N   UNL     1      -6.189  -2.092  -0.635  1.00  0.00           N  
HETATM   25  N   UNL     1      -6.470  -1.434   0.568  1.00  0.00           N  
HETATM   26  H   UNL     1      -5.313  -0.170   1.830  1.00  0.00           H  
HETATM   27  H   UNL     1      -4.408  -2.155  -1.871  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.073  -2.306  -0.360  1.00  0.00           H  
HETATM   29  HA  UNL     1       3.365   1.768   0.615  1.00  0.00           H  
HETATM   30  H1  UNL     1       2.908   2.210  -1.815  1.00  0.00           H  
HETATM   31  H2  UNL     1       4.639   1.988  -1.464  1.00  0.00           H  
HETATM   32  H   UNL     1       5.467   1.173   1.509  1.00  0.00           H  
HETATM   33  H   UNL     1       7.070  -0.588   2.135  1.00  0.00           H  
HETATM   34  H   UNL     1       6.801  -2.870   1.250  1.00  0.00           H  
HETATM   35  H   UNL     1       1.830  -0.550  -0.278  1.00  0.00           H  
HETATM   36  H   UNL     1       3.319  -1.633  -0.879  1.00  0.00           H  
HETATM   37  H   UNL     1       4.925  -3.392  -0.258  1.00  0.00           H  
HETATM   38  H   UNL     1       3.935   0.680  -3.335  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.423   2.539   0.390  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.597   3.688   0.731  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.043   3.276   1.494  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.125   3.559  -0.262  1.00  0.00           H  
HETATM   43  H   UNL     1       0.196  -1.370  -0.326  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.803  -2.655  -1.132  1.00  0.00           H  
CONECT    1   21    2    2   20                                       
CONECT    2    3    1    1    6                                       
CONECT    3    4    5    5    2                                       
CONECT    4   25   25    3   26                                       
CONECT    5   24    3    3   27                                       
CONECT    6    2   23   23   28                                       
CONECT    7   20   20   23   15                                       
CONECT    8   16    9   10   29                                       
CONECT    9   19    8   30   31                                       
CONECT   10   17    8   11   11                                       
CONECT   11   10   10   12   32                                       
CONECT   12   13   13   11   33                                       
CONECT   13   18   12   12   34                                       
CONECT   14   15   15                                                 
CONECT   15    7   16   14   14                                       
CONECT   16   15    8   35                                            
CONECT   17   18   18   10   36                                       
CONECT   18   17   17   13   37                                       
CONECT   19    9   38                                                 
CONECT   20    1    7    7   39                                       
CONECT   21   22    1                                                 
CONECT   22   21   40   41   42                                       
CONECT   23    6    6    7   43                                       
CONECT   24   25    5   44                                            
CONECT   25    4    4   24                                            
CONECT   26    4                                                      
CONECT   27    5                                                      
CONECT   28    6                                                      
CONECT   29    8                                                      
CONECT   30    9                                                      
CONECT   31    9                                                      
CONECT   32   11                                                      
CONECT   33   12                                                      
CONECT   34   13                                                      
CONECT   35   16                                                      
CONECT   36   17                                                      
CONECT   37   18                                                      
CONECT   38   19                                                      
CONECT   39   20                                                      
CONECT   40   22                                                      
CONECT   41   22                                                      
CONECT   42   22                                                      
CONECT   43   23                                                      
CONECT   44   24                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
