COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  C   UNL     1      -1.695  -0.334   0.736  1.00  0.00           C  
HETATM    2  O   UNL     1      -0.746   0.722   0.575  1.00  0.00           O  
HETATM    3  C   UNL     1      -3.081   0.156   0.308  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.081  -0.998   0.427  1.00  0.00           C  
HETATM    5  O   UNL     1      -5.362  -0.571  -0.040  1.00  0.00           O  
HETATM    6  C   UNL     1      -3.591  -2.173  -0.426  1.00  0.00           C  
HETATM    7  O   UNL     1      -2.519   2.757  -0.130  1.00  0.00           O  
HETATM    8  C   UNL     1      -3.202   2.530   0.846  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.717   3.669   1.688  1.00  0.00           C  
HETATM   10  N   UNL     1      -3.501   1.258   1.178  1.00  0.00           N  
HETATM   11  O   UNL     1      -4.478  -3.282  -0.266  1.00  0.00           O  
HETATM   12  C   UNL     1      -2.185  -2.573   0.030  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.665  -3.706  -0.856  1.00  0.00           C  
HETATM   14  O   UNL     1      -0.403  -4.158  -0.359  1.00  0.00           O  
HETATM   15  O   UNL     1      -1.313  -1.446  -0.076  1.00  0.00           O  
HETATM   16  C   UNL     1       0.521   0.463   1.183  1.00  0.00           C  
HETATM   17  C   UNL     1       1.495  -0.082   0.132  1.00  0.00           C  
HETATM   18  O   UNL     1       2.699  -0.507   0.773  1.00  0.00           O  
HETATM   19  C   UNL     1       3.365  -1.581   0.106  1.00  0.00           C  
HETATM   20  C   UNL     1       2.851  -2.915   0.651  1.00  0.00           C  
HETATM   21  C   UNL     1       4.849  -1.479   0.346  1.00  0.00           C  
HETATM   22  O   UNL     1       5.284  -0.633   1.092  1.00  0.00           O  
HETATM   23  O   UNL     1       5.688  -2.328  -0.268  1.00  0.00           O  
HETATM   24  C   UNL     1       1.097   1.770   1.753  1.00  0.00           C  
HETATM   25  O   UNL     1       1.132   2.730   0.669  1.00  0.00           O  
HETATM   26  C   UNL     1       2.598   1.535   2.044  1.00  0.00           C  
HETATM   27  O   UNL     1       3.273   1.902   0.828  1.00  0.00           O  
HETATM   28  C   UNL     1       2.257   2.282  -0.118  1.00  0.00           C  
HETATM   29  C   UNL     1       1.816   1.022  -0.881  1.00  0.00           C  
HETATM   30  N   UNL     1       0.622   1.322  -1.675  1.00  0.00           N  
HETATM   31  C   UNL     1       0.750   1.814  -2.923  1.00  0.00           C  
HETATM   32  O   UNL     1       1.849   1.920  -3.424  1.00  0.00           O  
HETATM   33  C   UNL     1      -0.474   2.231  -3.697  1.00  0.00           C  
HETATM   34  H   UNL     1      -1.724  -0.640   1.781  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.043   0.500  -0.725  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.157  -1.309   1.469  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.045  -1.254   0.007  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.564  -1.876  -1.474  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.687   3.990   1.309  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.821   3.339   2.721  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.014   4.501   1.641  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.993   1.072   1.993  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.228  -4.063  -0.779  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.221  -2.909   1.066  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.376  -4.532  -0.845  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.544  -3.344  -1.877  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.013  -4.878  -0.874  1.00  0.00           H  
HETATM   48  H   UNL     1       0.399  -0.264   1.986  1.00  0.00           H  
HETATM   49  H   UNL     1       1.039  -0.927  -0.383  1.00  0.00           H  
HETATM   50  H   UNL     1       3.165  -1.524  -0.964  1.00  0.00           H  
HETATM   51  H   UNL     1       1.777  -2.989   0.477  1.00  0.00           H  
HETATM   52  H   UNL     1       3.358  -3.735   0.142  1.00  0.00           H  
HETATM   53  H   UNL     1       3.050  -2.973   1.721  1.00  0.00           H  
HETATM   54  H   UNL     1       6.631  -2.224  -0.083  1.00  0.00           H  
HETATM   55  H   UNL     1       0.541   2.130   2.618  1.00  0.00           H  
HETATM   56  H   UNL     1       2.928   2.168   2.867  1.00  0.00           H  
HETATM   57  H   UNL     1       2.779   0.486   2.278  1.00  0.00           H  
HETATM   58  H   UNL     1       2.611   3.064  -0.790  1.00  0.00           H  
HETATM   59  H   UNL     1       2.619   0.691  -1.539  1.00  0.00           H  
HETATM   60  H   UNL     1      -0.260   1.167  -1.303  1.00  0.00           H  
HETATM   61  H   UNL     1      -1.354   2.148  -3.059  1.00  0.00           H  
HETATM   62  H   UNL     1      -0.361   3.264  -4.026  1.00  0.00           H  
HETATM   63  H   UNL     1      -0.593   1.584  -4.566  1.00  0.00           H  
CONECT    1   15    2    3   34                                       
CONECT    2   16    1                                                 
CONECT    3    1    4   10   35                                       
CONECT    4    6    3    5   36                                       
CONECT    5    4   37                                                 
CONECT    6   12   11    4   38                                       
CONECT    7    8    8                                                 
CONECT    8    7    7   10    9                                       
CONECT    9    8   39   40   41                                       
CONECT   10    3    8   42                                            
CONECT   11    6   43                                                 
CONECT   12   13   15    6   44                                       
CONECT   13   14   12   45   46                                       
CONECT   14   13   47                                                 
CONECT   15   12    1                                                 
CONECT   16   17    2   24   48                                       
CONECT   17   18   29   16   49                                       
CONECT   18   19   17                                                 
CONECT   19   21   20   18   50                                       
CONECT   20   19   51   52   53                                       
CONECT   21   22   22   23   19                                       
CONECT   22   21   21                                                 
CONECT   23   21   54                                                 
CONECT   24   16   26   25   55                                       
CONECT   25   28   24                                                 
CONECT   26   27   24   56   57                                       
CONECT   27   26   28                                                 
CONECT   28   29   27   25   58                                       
CONECT   29   17   30   28   59                                       
CONECT   30   31   29   60                                            
CONECT   31   32   32   30   33                                       
CONECT   32   31   31                                                 
CONECT   33   31   61   62   63                                       
CONECT   34    1                                                      
CONECT   35    3                                                      
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39    9                                                      
CONECT   40    9                                                      
CONECT   41    9                                                      
CONECT   42   10                                                      
CONECT   43   11                                                      
CONECT   44   12                                                      
CONECT   45   13                                                      
CONECT   46   13                                                      
CONECT   47   14                                                      
CONECT   48   16                                                      
CONECT   49   17                                                      
CONECT   50   19                                                      
CONECT   51   20                                                      
CONECT   52   20                                                      
CONECT   53   20                                                      
CONECT   54   23                                                      
CONECT   55   24                                                      
CONECT   56   26                                                      
CONECT   57   26                                                      
CONECT   58   28                                                      
CONECT   59   29                                                      
CONECT   60   30                                                      
CONECT   61   33                                                      
CONECT   62   33                                                      
CONECT   63   33                                                      
MASTER        0    0    0    0    0    0    0    0   63    0   63    0
END
