COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.316  -4.789   1.890  1.00  0.00           C  
HETATM    2  O   UNL     1       1.028  -3.392   1.968  1.00  0.00           O  
HETATM    3  C   UNL     1       1.978  -2.539   1.505  1.00  0.00           C  
HETATM    4  C   UNL     1       3.169  -3.050   0.978  1.00  0.00           C  
HETATM    5  C   UNL     1       4.137  -2.221   0.508  1.00  0.00           C  
HETATM    6  C   UNL     1       3.946  -0.827   0.548  1.00  0.00           C  
HETATM    7  C   UNL     1       4.929   0.050   0.069  1.00  0.00           C  
HETATM    8  C   UNL     1       4.709   1.418   0.124  1.00  0.00           C  
HETATM    9  C   UNL     1       5.740   2.346  -0.379  1.00  0.00           C  
HETATM   10  O   UNL     1       6.777   1.912  -0.838  1.00  0.00           O  
HETATM   11  O   UNL     1       5.530   3.677  -0.329  1.00  0.00           O  
HETATM   12  C   UNL     1       3.509   1.927   0.654  1.00  0.00           C  
HETATM   13  C   UNL     1       2.547   1.093   1.123  1.00  0.00           C  
HETATM   14  C   UNL     1       2.741  -0.301   1.081  1.00  0.00           C  
HETATM   15  C   UNL     1       1.756  -1.181   1.555  1.00  0.00           C  
HETATM   16  C   UNL     1       0.467  -0.644   2.119  1.00  0.00           C  
HETATM   17  N   UNL     1      -0.473  -0.381   1.026  1.00  0.00           N  
HETATM   18  C   UNL     1      -1.276  -1.366   0.565  1.00  0.00           C  
HETATM   19  O   UNL     1      -1.179  -2.490   1.011  1.00  0.00           O  
HETATM   20  C   UNL     1      -0.552   0.895   0.451  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.652   2.023   1.248  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.722   3.274   0.663  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.692   3.401  -0.713  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.594   2.277  -1.514  1.00  0.00           C  
HETATM   25  C   UNL     1      -0.524   1.021  -0.937  1.00  0.00           C  
HETATM   26  O   UNL     1      -0.434  -0.090  -1.713  1.00  0.00           O  
HETATM   27  C   UNL     1      -1.608  -0.886  -1.853  1.00  0.00           C  
HETATM   28  C   UNL     1      -1.226  -2.263  -2.408  1.00  0.00           C  
HETATM   29  C   UNL     1      -0.614  -2.091  -3.800  1.00  0.00           C  
HETATM   30  O   UNL     1      -1.550  -1.426  -4.651  1.00  0.00           O  
HETATM   31  C   UNL     1      -1.911  -0.116  -4.208  1.00  0.00           C  
HETATM   32  C   UNL     1      -2.572  -0.207  -2.831  1.00  0.00           C  
HETATM   33  C   UNL     1      -2.293  -1.062  -0.505  1.00  0.00           C  
HETATM   34  N   UNL     1      -3.002   0.171  -0.155  1.00  0.00           N  
HETATM   35  C   UNL     1      -4.056   0.128   0.683  1.00  0.00           C  
HETATM   36  O   UNL     1      -4.418  -0.932   1.147  1.00  0.00           O  
HETATM   37  C   UNL     1      -4.786   1.397   1.042  1.00  0.00           C  
HETATM   38  C   UNL     1      -3.816   2.369   1.718  1.00  0.00           C  
HETATM   39  N   UNL     1      -5.887   1.085   1.962  1.00  0.00           N  
HETATM   40  C   UNL     1      -6.946   2.099   1.880  1.00  0.00           C  
HETATM   41  H   UNL     1       1.479  -5.069   0.849  1.00  0.00           H  
HETATM   42  H   UNL     1       2.214  -5.008   2.469  1.00  0.00           H  
HETATM   43  H   UNL     1       0.477  -5.357   2.292  1.00  0.00           H  
HETATM   44  H   UNL     1       3.321  -4.119   0.944  1.00  0.00           H  
HETATM   45  H   UNL     1       5.051  -2.630   0.104  1.00  0.00           H  
HETATM   46  H   UNL     1       5.852  -0.337  -0.339  1.00  0.00           H  
HETATM   47  H   UNL     1       6.234   4.245  -0.669  1.00  0.00           H  
HETATM   48  H   UNL     1       3.352   2.995   0.689  1.00  0.00           H  
HETATM   49  H   UNL     1       1.631   1.498   1.527  1.00  0.00           H  
HETATM   50  H   UNL     1       0.035  -1.376   2.801  1.00  0.00           H  
HETATM   51  H   UNL     1       0.664   0.283   2.658  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.676   1.926   2.323  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.799   4.155   1.284  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.746   4.380  -1.164  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.572   2.381  -2.589  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.498  -2.733  -1.746  1.00  0.00           H  
HETATM   57  H   UNL     1      -2.116  -2.888  -2.475  1.00  0.00           H  
HETATM   58  H   UNL     1       0.296  -1.496  -3.727  1.00  0.00           H  
HETATM   59  H   UNL     1      -0.376  -3.070  -4.216  1.00  0.00           H  
HETATM   60  H   UNL     1      -1.016   0.504  -4.141  1.00  0.00           H  
HETATM   61  H   UNL     1      -2.608   0.328  -4.918  1.00  0.00           H  
HETATM   62  H   UNL     1      -3.488  -0.794  -2.906  1.00  0.00           H  
HETATM   63  H   UNL     1      -2.809   0.795  -2.474  1.00  0.00           H  
HETATM   64  H   UNL     1      -3.007  -1.882  -0.567  1.00  0.00           H  
HETATM   65  H   UNL     1      -2.712   1.019  -0.527  1.00  0.00           H  
HETATM   66  H   UNL     1      -5.187   1.854   0.137  1.00  0.00           H  
HETATM   67  H   UNL     1      -4.344   3.286   1.978  1.00  0.00           H  
HETATM   68  H   UNL     1      -3.415   1.911   2.622  1.00  0.00           H  
HETATM   69  H   UNL     1      -2.999   2.600   1.035  1.00  0.00           H  
HETATM   70  H   UNL     1      -5.551   0.989   2.909  1.00  0.00           H  
HETATM   71  H   UNL     1      -6.536   3.075   2.144  1.00  0.00           H  
HETATM   72  H   UNL     1      -7.339   2.133   0.864  1.00  0.00           H  
HETATM   73  H   UNL     1      -7.749   1.844   2.571  1.00  0.00           H  
CONECT    1    2   41   42   43                                       
CONECT    2    1    3                                                 
CONECT    3    2   15   15    4                                       
CONECT    4    3    5    5   44                                       
CONECT    5    4    4    6   45                                       
CONECT    6   14    5    7    7                                       
CONECT    7    6    6    8   46                                       
CONECT    8   12   12    7    9                                       
CONECT    9    8   10   10   11                                       
CONECT   10    9    9                                                 
CONECT   11    9   47                                                 
CONECT   12   13    8    8   48                                       
CONECT   13   14   14   12   49                                       
CONECT   14   15   13   13    6                                       
CONECT   15   16    3    3   14                                       
CONECT   16   17   15   50   51                                       
CONECT   17   20   18   16                                            
CONECT   18   33   17   19   19                                       
CONECT   19   18   18                                                 
CONECT   20   21   21   25   17                                       
CONECT   21   22   20   20   52                                       
CONECT   22   23   23   21   53                                       
CONECT   23   22   22   24   54                                       
CONECT   24   23   25   25   55                                       
CONECT   25   24   24   20   26                                       
CONECT   26   25   27                                                 
CONECT   27   28   33   26   32                                       
CONECT   28   29   27   56   57                                       
CONECT   29   28   30   58   59                                       
CONECT   30   29   31                                                 
CONECT   31   30   32   60   61                                       
CONECT   32   27   31   62   63                                       
CONECT   33   34   27   18   64                                       
CONECT   34   35   33   65                                            
CONECT   35   36   36   37   34                                       
CONECT   36   35   35                                                 
CONECT   37   39   35   38   66                                       
CONECT   38   37   67   68   69                                       
CONECT   39   40   37   70                                            
CONECT   40   39   71   72   73                                       
CONECT   41    1                                                      
CONECT   42    1                                                      
CONECT   43    1                                                      
CONECT   44    4                                                      
CONECT   45    5                                                      
CONECT   46    7                                                      
CONECT   47   11                                                      
CONECT   48   12                                                      
CONECT   49   13                                                      
CONECT   50   16                                                      
CONECT   51   16                                                      
CONECT   52   21                                                      
CONECT   53   22                                                      
CONECT   54   23                                                      
CONECT   55   24                                                      
CONECT   56   28                                                      
CONECT   57   28                                                      
CONECT   58   29                                                      
CONECT   59   29                                                      
CONECT   60   31                                                      
CONECT   61   31                                                      
CONECT   62   32                                                      
CONECT   63   32                                                      
CONECT   64   33                                                      
CONECT   65   34                                                      
CONECT   66   37                                                      
CONECT   67   38                                                      
CONECT   68   38                                                      
CONECT   69   38                                                      
CONECT   70   39                                                      
CONECT   71   40                                                      
CONECT   72   40                                                      
CONECT   73   40                                                      
MASTER        0    0    0    0    0    0    0    0   73    0   73    0
END
