COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.754  -0.017   0.237  1.00  0.00           C  
HETATM    2  C   UNL     1       2.024  -0.531   0.201  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.550   0.024  -0.144  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.309  -0.246  -0.032  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.783   0.929  -0.484  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.389   1.091  -0.549  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.549   2.401  -1.054  1.00  0.00           C  
HETATM    8  C   UNL     1      -7.937   0.358  -0.253  1.00  0.00           C  
HETATM    9  C   UNL     1       9.303  -0.894  -1.490  1.00  0.00           C  
HETATM   10  N   UNL     1       8.392  -0.230  -0.554  1.00  0.00           N  
HETATM   11  C   UNL     1       7.061  -0.403  -0.673  1.00  0.00           C  
HETATM   12  O   UNL     1       6.616  -1.110  -1.557  1.00  0.00           O  
HETATM   13  C   UNL     1       6.143   0.264   0.269  1.00  0.00           C  
HETATM   14  C   UNL     1       6.630   1.174   1.196  1.00  0.00           C  
HETATM   15  C   UNL     1       5.771   1.807   2.086  1.00  0.00           C  
HETATM   16  C   UNL     1       4.433   1.554   2.075  1.00  0.00           C  
HETATM   17  C   UNL     1       3.895   0.638   1.153  1.00  0.00           C  
HETATM   18  C   UNL     1       4.219  -0.925  -0.686  1.00  0.00           C  
HETATM   19  C   UNL     1       2.880  -1.172  -0.699  1.00  0.00           C  
HETATM   20  C   UNL     1       2.518   0.363   1.124  1.00  0.00           C  
HETATM   21  O   UNL     1       0.693  -0.800   0.170  1.00  0.00           O  
HETATM   22  C   UNL     1      -0.149   0.193  -0.206  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.118  -1.174   0.315  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.476  -1.301   0.368  1.00  0.00           C  
HETATM   25  N   UNL     1      -1.849   2.234  -0.986  1.00  0.00           N  
HETATM   26  C   UNL     1       0.338   1.405  -0.665  1.00  0.00           C  
HETATM   27  O   UNL     1      -5.658  -0.397   0.029  1.00  0.00           O  
HETATM   28  C   UNL     1      -6.455   0.712  -0.393  1.00  0.00           C  
HETATM   29  C   UNL     1      -8.958   1.376  -0.765  1.00  0.00           C  
HETATM   30  C   UNL     1      -8.768   1.173   0.740  1.00  0.00           C  
HETATM   31  N   UNL     1      -8.265  -1.066  -0.404  1.00  0.00           N  
HETATM   32  O   UNL     1      -4.027  -2.462   0.813  1.00  0.00           O  
HETATM   33  C   UNL     1      -3.126  -3.499   1.206  1.00  0.00           C  
HETATM   34  H   UNL     1      -4.436   1.733  -0.790  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.158   3.341  -1.413  1.00  0.00           H  
HETATM   36  H   UNL     1       9.084  -0.563  -2.506  1.00  0.00           H  
HETATM   37  H   UNL     1      10.332  -0.637  -1.238  1.00  0.00           H  
HETATM   38  H   UNL     1       9.171  -1.973  -1.423  1.00  0.00           H  
HETATM   39  H   UNL     1       8.747   0.333   0.151  1.00  0.00           H  
HETATM   40  H   UNL     1       7.687   1.393   1.225  1.00  0.00           H  
HETATM   41  H   UNL     1       6.172   2.512   2.799  1.00  0.00           H  
HETATM   42  H   UNL     1       3.783   2.057   2.777  1.00  0.00           H  
HETATM   43  H   UNL     1       4.868  -1.428  -1.388  1.00  0.00           H  
HETATM   44  H   UNL     1       2.475  -1.873  -1.413  1.00  0.00           H  
HETATM   45  H   UNL     1       1.850   0.854   1.816  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.485  -1.992   0.626  1.00  0.00           H  
HETATM   47  H   UNL     1       1.403   1.571  -0.732  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.233   0.943  -1.435  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.228   1.579   0.228  1.00  0.00           H  
HETATM   50  H   UNL     1      -8.574   2.299  -1.200  1.00  0.00           H  
HETATM   51  H   UNL     1      -9.873   0.990  -1.213  1.00  0.00           H  
HETATM   52  H   UNL     1      -9.558   0.652   1.281  1.00  0.00           H  
HETATM   53  H   UNL     1      -8.259   1.962   1.294  1.00  0.00           H  
HETATM   54  H   UNL     1      -7.528  -1.648  -0.036  1.00  0.00           H  
HETATM   55  H   UNL     1      -9.148  -1.282   0.033  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.500  -3.778   0.358  1.00  0.00           H  
HETATM   57  H   UNL     1      -2.495  -3.143   2.021  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.694  -4.367   1.540  1.00  0.00           H  
CONECT    1   13   18   18   17                                       
CONECT    2   19   19   20   21                                       
CONECT    3   22   22    6   23                                       
CONECT    4    5    5   24   27                                       
CONECT    5    6    4    4   34                                       
CONECT    6   25   25    3    5                                       
CONECT    7   26   26   25   35                                       
CONECT    8   28   31   29   30                                       
CONECT    9   10   36   37   38                                       
CONECT   10    9   11   39                                            
CONECT   11   10   12   12   13                                       
CONECT   12   11   11                                                 
CONECT   13   11   14   14    1                                       
CONECT   14   13   13   15   40                                       
CONECT   15   14   16   16   41                                       
CONECT   16   15   15   17   42                                       
CONECT   17    1   16   20   20                                       
CONECT   18    1    1   19   43                                       
CONECT   19   18    2    2   44                                       
CONECT   20   17   17    2   45                                       
CONECT   21    2   22                                                 
CONECT   22   26   21    3    3                                       
CONECT   23    3   24   24   46                                       
CONECT   24   23   23    4   32                                       
CONECT   25    7    6    6                                            
CONECT   26    7    7   22   47                                       
CONECT   27    4   28                                                 
CONECT   28   27    8   48   49                                       
CONECT   29    8   30   50   51                                       
CONECT   30    8   29   52   53                                       
CONECT   31    8   54   55                                            
CONECT   32   24   33                                                 
CONECT   33   32   56   57   58                                       
CONECT   34    5                                                      
CONECT   35    7                                                      
CONECT   36    9                                                      
CONECT   37    9                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   14                                                      
CONECT   41   15                                                      
CONECT   42   16                                                      
CONECT   43   18                                                      
CONECT   44   19                                                      
CONECT   45   20                                                      
CONECT   46   23                                                      
CONECT   47   26                                                      
CONECT   48   28                                                      
CONECT   49   28                                                      
CONECT   50   29                                                      
CONECT   51   29                                                      
CONECT   52   30                                                      
CONECT   53   30                                                      
CONECT   54   31                                                      
CONECT   55   31                                                      
CONECT   56   33                                                      
CONECT   57   33                                                      
CONECT   58   33                                                      
MASTER        0    0    0    0    0    0    0    0   58    0   58    0
END
