COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.682   0.063  -0.670  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.034  -0.435   0.624  1.00  0.00           C  
HETATM    3  C   UNL     1       2.253   0.502   0.695  1.00  0.00           C  
HETATM    4  C   UNL     1       3.647   0.373   0.505  1.00  0.00           C  
HETATM    5  C   UNL     1       3.417  -1.806  -0.198  1.00  0.00           C  
HETATM    6  C   UNL     1       3.969  -3.090  -0.685  1.00  0.00           C  
HETATM    7  C   UNL     1       1.773  -3.919  -0.729  1.00  0.00           C  
HETATM    8  C   UNL     1       1.959  -1.724  -0.017  1.00  0.00           C  
HETATM    9  C   UNL     1       4.485   1.472   0.783  1.00  0.00           C  
HETATM   10  C   UNL     1       3.947   2.640   1.229  1.00  0.00           C  
HETATM   11  C   UNL     1       4.849   3.811   1.524  1.00  0.00           C  
HETATM   12  C   UNL     1       2.574   2.766   1.416  1.00  0.00           C  
HETATM   13  C   UNL     1       2.004   4.070   1.911  1.00  0.00           C  
HETATM   14  N   UNL     1       1.413  -0.558   0.430  1.00  0.00           N  
HETATM   15  C   UNL     1      -2.477   2.359  -1.508  1.00  0.00           C  
HETATM   16  O   UNL     1      -6.575  -1.025   1.395  1.00  0.00           O  
HETATM   17  O   UNL     1       1.034  -4.859  -0.965  1.00  0.00           O  
HETATM   18  C   UNL     1      -3.278   3.164  -0.720  1.00  0.00           C  
HETATM   19  C   UNL     1       1.731   1.708   1.158  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.758   0.882  -1.608  1.00  0.00           C  
HETATM   21  O   UNL     1      -6.822  -3.205   1.660  1.00  0.00           O  
HETATM   22  C   UNL     1      -6.111  -2.133   1.274  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.734  -2.314   0.689  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.147  -0.946   0.335  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.749  -1.129  -0.259  1.00  0.00           C  
HETATM   26  N   UNL     1      -2.132   0.187  -0.475  1.00  0.00           N  
HETATM   27  C   UNL     1      -1.421   2.910  -2.210  1.00  0.00           C  
HETATM   28  C   UNL     1      -1.166   4.266  -2.123  1.00  0.00           C  
HETATM   29  C   UNL     1      -1.967   5.071  -1.335  1.00  0.00           C  
HETATM   30  C   UNL     1      -3.023   4.520  -0.633  1.00  0.00           C  
HETATM   31  N   UNL     1       4.179  -0.775   0.066  1.00  0.00           N  
HETATM   32  N   UNL     1       1.224  -2.788  -0.294  1.00  0.00           N  
HETATM   33  N   UNL     1       3.088  -4.089  -0.925  1.00  0.00           N  
HETATM   34  O   UNL     1       5.162  -3.241  -0.862  1.00  0.00           O  
HETATM   35  H   UNL     1      -0.266   1.036  -0.933  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.482  -0.647  -1.472  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.234   0.275   1.427  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.450  -1.407   0.888  1.00  0.00           H  
HETATM   39  H   UNL     1       5.552   1.387   0.642  1.00  0.00           H  
HETATM   40  H   UNL     1       4.964   4.417   0.625  1.00  0.00           H  
HETATM   41  H   UNL     1       4.411   4.417   2.317  1.00  0.00           H  
HETATM   42  H   UNL     1       5.825   3.446   1.844  1.00  0.00           H  
HETATM   43  H   UNL     1       1.765   4.708   1.061  1.00  0.00           H  
HETATM   44  H   UNL     1       1.099   3.876   2.487  1.00  0.00           H  
HETATM   45  H   UNL     1       2.737   4.569   2.545  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.103   2.733  -0.172  1.00  0.00           H  
HETATM   47  H   UNL     1       0.667   1.815   1.306  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.835   0.715  -1.586  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.349   0.496  -2.541  1.00  0.00           H  
HETATM   50  H   UNL     1      -7.700  -3.039   2.029  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.091  -2.807   1.418  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.799  -2.925  -0.211  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.790  -0.452  -0.394  1.00  0.00           H  
HETATM   54  H   UNL     1      -4.082  -0.335   1.235  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.135  -1.709   0.430  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.825  -1.655  -1.210  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.795   2.281  -2.825  1.00  0.00           H  
HETATM   58  H   UNL     1      -0.341   4.697  -2.671  1.00  0.00           H  
HETATM   59  H   UNL     1      -1.768   6.130  -1.267  1.00  0.00           H  
HETATM   60  H   UNL     1      -3.649   5.149  -0.017  1.00  0.00           H  
HETATM   61  H   UNL     1       3.415  -4.944  -1.245  1.00  0.00           H  
CONECT    1    2   26   35   36                                       
CONECT    2   14    1   37   38                                       
CONECT    3    4    4   19   14                                       
CONECT    4    9   31    3    3                                       
CONECT    5   31   31    6    8                                       
CONECT    6   34   34    5   33                                       
CONECT    7   33   32   17   17                                       
CONECT    8    5   14   32   32                                       
CONECT    9   10   10    4   39                                       
CONECT   10   11    9    9   12                                       
CONECT   11   10   40   41   42                                       
CONECT   12   10   13   19   19                                       
CONECT   13   12   43   44   45                                       
CONECT   14    3    8    2                                            
CONECT   15   18   20   27   27                                       
CONECT   16   22   22                                                 
CONECT   17    7    7                                                 
CONECT   18   30   30   15   46                                       
CONECT   19   12   12    3   47                                       
CONECT   20   26   15   48   49                                       
CONECT   21   22   50                                                 
CONECT   22   23   16   16   21                                       
CONECT   23   24   22   51   52                                       
CONECT   24   23   25   53   54                                       
CONECT   25   24   26   55   56                                       
CONECT   26    1   20   25                                            
CONECT   27   15   15   28   57                                       
CONECT   28   29   29   27   58                                       
CONECT   29   30   28   28   59                                       
CONECT   30   18   18   29   60                                       
CONECT   31    4    5    5                                            
CONECT   32    8    8    7                                            
CONECT   33    6    7   61                                            
CONECT   34    6    6                                                 
CONECT   35    1                                                      
CONECT   36    1                                                      
CONECT   37    2                                                      
CONECT   38    2                                                      
CONECT   39    9                                                      
CONECT   40   11                                                      
CONECT   41   11                                                      
CONECT   42   11                                                      
CONECT   43   13                                                      
CONECT   44   13                                                      
CONECT   45   13                                                      
CONECT   46   18                                                      
CONECT   47   19                                                      
CONECT   48   20                                                      
CONECT   49   20                                                      
CONECT   50   21                                                      
CONECT   51   23                                                      
CONECT   52   23                                                      
CONECT   53   24                                                      
CONECT   54   24                                                      
CONECT   55   25                                                      
CONECT   56   25                                                      
CONECT   57   27                                                      
CONECT   58   28                                                      
CONECT   59   29                                                      
CONECT   60   30                                                      
CONECT   61   33                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
