COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       7.793  -0.598   1.567  1.00  0.00           C  
HETATM    2  N   UNL     1       6.898   0.398  -0.454  1.00  0.00           N  
HETATM    3  O   UNL     1       7.974   1.384  -0.560  1.00  0.00           O  
HETATM    4  C   UNL     1       6.570   0.092   0.922  1.00  0.00           C  
HETATM    5  N   UNL     1       3.093  -1.311   0.329  1.00  0.00           N  
HETATM    6  O   UNL     1       1.620   0.269  -0.188  1.00  0.00           O  
HETATM    7  C   UNL     1       5.383  -0.859   1.054  1.00  0.00           C  
HETATM    8  N   UNL     1      -6.613  -2.067  -0.232  1.00  0.00           N  
HETATM    9  O   UNL     1      -3.332   2.310   2.982  1.00  0.00           O  
HETATM   10  C   UNL     1       4.213  -0.370   0.200  1.00  0.00           C  
HETATM   11  N   UNL     1      -4.805  -0.605  -0.609  1.00  0.00           N  
HETATM   12  C   UNL     1       4.664  -0.321  -1.260  1.00  0.00           C  
HETATM   13  N   UNL     1      -3.410  -0.649  -0.511  1.00  0.00           N  
HETATM   14  C   UNL     1       5.845   0.633  -1.421  1.00  0.00           C  
HETATM   15  N   UNL     1      -5.201   1.622  -1.375  1.00  0.00           N  
HETATM   16  C   UNL     1       5.346   2.081  -1.356  1.00  0.00           C  
HETATM   17  C   UNL     1       6.430   0.414  -2.834  1.00  0.00           C  
HETATM   18  C   UNL     1       1.831  -0.890   0.113  1.00  0.00           C  
HETATM   19  C   UNL     1       0.704  -1.838   0.244  1.00  0.00           C  
HETATM   20  C   UNL     1       0.945  -3.168   0.590  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.108  -4.053   0.711  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.404  -3.628   0.492  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.657  -2.302   0.145  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.603  -1.403   0.027  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.051  -1.848  -0.090  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.202  -2.619   0.097  1.00  0.00           C  
HETATM   27  C   UNL     1      -5.293  -1.829  -0.231  1.00  0.00           C  
HETATM   28  C   UNL     1      -7.469  -1.136  -0.593  1.00  0.00           C  
HETATM   29  C   UNL     1      -7.017   0.124  -0.985  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.674   0.384  -0.991  1.00  0.00           C  
HETATM   31  C   UNL     1      -4.426   2.379  -0.492  1.00  0.00           C  
HETATM   32  C   UNL     1      -3.818   3.549  -0.928  1.00  0.00           C  
HETATM   33  C   UNL     1      -3.052   4.297  -0.054  1.00  0.00           C  
HETATM   34  C   UNL     1      -2.889   3.884   1.254  1.00  0.00           C  
HETATM   35  C   UNL     1      -3.494   2.715   1.695  1.00  0.00           C  
HETATM   36  C   UNL     1      -4.268   1.965   0.824  1.00  0.00           C  
HETATM   37  C   UNL     1       6.295   1.370   1.724  1.00  0.00           C  
HETATM   38  H   UNL     1       8.651   0.072   1.527  1.00  0.00           H  
HETATM   39  H   UNL     1       7.568  -0.839   2.606  1.00  0.00           H  
HETATM   40  H   UNL     1       8.021  -1.515   1.023  1.00  0.00           H  
HETATM   41  H   UNL     1       8.214   1.609  -1.469  1.00  0.00           H  
HETATM   42  H   UNL     1       3.262  -2.235   0.570  1.00  0.00           H  
HETATM   43  H   UNL     1       5.679  -1.857   0.726  1.00  0.00           H  
HETATM   44  H   UNL     1       5.071  -0.909   2.100  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.002   2.653   3.590  1.00  0.00           H  
HETATM   46  H   UNL     1       3.888   0.614   0.529  1.00  0.00           H  
HETATM   47  H   UNL     1       4.959  -1.323  -1.581  1.00  0.00           H  
HETATM   48  H   UNL     1       3.835   0.018  -1.884  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.407   1.967  -2.258  1.00  0.00           H  
HETATM   50  H   UNL     1       6.172   2.760  -1.569  1.00  0.00           H  
HETATM   51  H   UNL     1       4.556   2.227  -2.093  1.00  0.00           H  
HETATM   52  H   UNL     1       4.956   2.287  -0.359  1.00  0.00           H  
HETATM   53  H   UNL     1       6.798  -0.608  -2.921  1.00  0.00           H  
HETATM   54  H   UNL     1       5.654   0.585  -3.579  1.00  0.00           H  
HETATM   55  H   UNL     1       7.252   1.111  -2.999  1.00  0.00           H  
HETATM   56  H   UNL     1       1.956  -3.507   0.762  1.00  0.00           H  
HETATM   57  H   UNL     1       0.082  -5.082   0.979  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.223  -4.326   0.588  1.00  0.00           H  
HETATM   59  H   UNL     1      -0.795  -0.373  -0.237  1.00  0.00           H  
HETATM   60  H   UNL     1      -4.235  -3.644   0.436  1.00  0.00           H  
HETATM   61  H   UNL     1      -8.528  -1.349  -0.587  1.00  0.00           H  
HETATM   62  H   UNL     1      -7.721   0.887  -1.282  1.00  0.00           H  
HETATM   63  H   UNL     1      -3.944   3.874  -1.950  1.00  0.00           H  
HETATM   64  H   UNL     1      -2.580   5.207  -0.395  1.00  0.00           H  
HETATM   65  H   UNL     1      -2.289   4.471   1.934  1.00  0.00           H  
HETATM   66  H   UNL     1      -4.743   1.058   1.167  1.00  0.00           H  
HETATM   67  H   UNL     1       7.169   2.020   1.682  1.00  0.00           H  
HETATM   68  H   UNL     1       5.436   1.888   1.299  1.00  0.00           H  
HETATM   69  H   UNL     1       6.085   1.109   2.762  1.00  0.00           H  
CONECT    1    4   38   39   40                                       
CONECT    2    3    4   14                                            
CONECT    3    2   41                                                 
CONECT    4    1    2    7   37                                       
CONECT    5   10   18   42                                            
CONECT    6   18   18                                                 
CONECT    7    4   10   43   44                                       
CONECT    8   27   28   28                                            
CONECT    9   35   45                                                 
CONECT   10    5    7   12   46                                       
CONECT   11   13   27   30                                            
CONECT   12   10   14   47   48                                       
CONECT   13   11   25   25                                            
CONECT   14    2   12   16   17                                       
CONECT   15   30   31   49                                            
CONECT   16   14   50   51   52                                       
CONECT   17   14   53   54   55                                       
CONECT   18    5    6    6   19                                       
CONECT   19   18   20   20   24                                       
CONECT   20   19   19   21   56                                       
CONECT   21   20   22   22   57                                       
CONECT   22   21   21   23   58                                       
CONECT   23   22   24   24   25                                       
CONECT   24   19   23   23   59                                       
CONECT   25   13   13   23   26                                       
CONECT   26   25   27   27   60                                       
CONECT   27    8   11   26   26                                       
CONECT   28    8    8   29   61                                       
CONECT   29   28   30   30   62                                       
CONECT   30   11   15   29   29                                       
CONECT   31   15   32   32   36                                       
CONECT   32   31   31   33   63                                       
CONECT   33   32   34   34   64                                       
CONECT   34   33   33   35   65                                       
CONECT   35    9   34   36   36                                       
CONECT   36   31   35   35   66                                       
CONECT   37    4   67   68   69                                       
CONECT   38    1                                                      
CONECT   39    1                                                      
CONECT   40    1                                                      
CONECT   41    3                                                      
CONECT   42    5                                                      
CONECT   43    7                                                      
CONECT   44    7                                                      
CONECT   45    9                                                      
CONECT   46   10                                                      
CONECT   47   12                                                      
CONECT   48   12                                                      
CONECT   49   15                                                      
CONECT   50   16                                                      
CONECT   51   16                                                      
CONECT   52   16                                                      
CONECT   53   17                                                      
CONECT   54   17                                                      
CONECT   55   17                                                      
CONECT   56   20                                                      
CONECT   57   21                                                      
CONECT   58   22                                                      
CONECT   59   24                                                      
CONECT   60   26                                                      
CONECT   61   28                                                      
CONECT   62   29                                                      
CONECT   63   32                                                      
CONECT   64   33                                                      
CONECT   65   34                                                      
CONECT   66   36                                                      
CONECT   67   37                                                      
CONECT   68   37                                                      
CONECT   69   37                                                      
MASTER        0    0    0    0    0    0    0    0   69    0   69    0
END
