COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       7.081   1.046   1.033  1.00  0.00           C  
HETATM    2  C   UNL     1       6.144  -0.163   0.926  1.00  0.00           C  
HETATM    3  C   UNL     1       2.747  -1.024  -1.475  1.00  0.00           C  
HETATM    4  C   UNL     1       1.332  -0.511  -1.399  1.00  0.00           C  
HETATM    5  C   UNL     1       0.462  -1.524  -0.651  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.267  -3.846   1.255  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.615  -3.463   1.376  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.546  -4.282   2.038  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.843  -3.882   2.139  1.00  0.00           C  
HETATM   10  C   UNL     1      -6.264  -2.671   1.595  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.389  -1.852   0.948  1.00  0.00           C  
HETATM   12  C   UNL     1       2.583  -2.307  -3.677  1.00  0.00           C  
HETATM   13  C   UNL     1       3.288  -1.794  -2.448  1.00  0.00           C  
HETATM   14  C   UNL     1       5.524  -2.806  -2.901  1.00  0.00           C  
HETATM   15  C   UNL     1       3.791  -0.797  -0.547  1.00  0.00           C  
HETATM   16  C   UNL     1       3.706  -0.003   0.696  1.00  0.00           C  
HETATM   17  C   UNL     1       4.737   0.896   2.733  1.00  0.00           C  
HETATM   18  C   UNL     1       5.743   2.053   2.753  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.787  -1.822   0.057  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.382  -3.038   0.612  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.044  -2.231   0.825  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.108  -1.405   0.160  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.533  -0.116  -0.430  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.029   1.094   0.053  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.456   2.280  -0.530  1.00  0.00           C  
HETATM   26  C   UNL     1      -3.539   4.619  -0.810  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.034   5.935  -0.213  1.00  0.00           C  
HETATM   28  C   UNL     1      -0.991   4.838   0.479  1.00  0.00           C  
HETATM   29  C   UNL     1      -1.495   3.522  -0.117  1.00  0.00           C  
HETATM   30  C   UNL     1      -4.819   1.142  -2.013  1.00  0.00           C  
HETATM   31  C   UNL     1      -4.448  -0.077  -1.491  1.00  0.00           C  
HETATM   32  N   UNL     1       4.577  -2.015  -2.112  1.00  0.00           N  
HETATM   33  N   UNL     1       4.856  -1.423  -1.006  1.00  0.00           N  
HETATM   34  N   UNL     1       4.817   0.234   1.421  1.00  0.00           N  
HETATM   35  N   UNL     1      -2.964   3.493  -0.062  1.00  0.00           N  
HETATM   36  N   UNL     1      -1.566   5.965  -0.269  1.00  0.00           N  
HETATM   37  N   UNL     1      -4.327   2.268  -1.528  1.00  0.00           N  
HETATM   38  O   UNL     1       7.029   1.565   2.364  1.00  0.00           O  
HETATM   39  O   UNL     1       2.634   0.437   1.064  1.00  0.00           O  
HETATM   40  O   UNL     1      -0.880  -1.037  -0.579  1.00  0.00           O  
HETATM   41  H   UNL     1       8.101   0.738   0.802  1.00  0.00           H  
HETATM   42  H   UNL     1       6.765   1.816   0.329  1.00  0.00           H  
HETATM   43  H   UNL     1       6.069  -0.477  -0.115  1.00  0.00           H  
HETATM   44  H   UNL     1       6.532  -0.983   1.530  1.00  0.00           H  
HETATM   45  H   UNL     1       1.319   0.441  -0.868  1.00  0.00           H  
HETATM   46  H   UNL     1       0.942  -0.370  -2.407  1.00  0.00           H  
HETATM   47  H   UNL     1       0.475  -2.476  -1.182  1.00  0.00           H  
HETATM   48  H   UNL     1       0.852  -1.664   0.356  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.933  -4.782   1.678  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.233  -5.224   2.463  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.556  -4.514   2.647  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.299  -2.376   1.689  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.729  -0.915   0.531  1.00  0.00           H  
HETATM   54  H   UNL     1       2.693  -1.586  -4.486  1.00  0.00           H  
HETATM   55  H   UNL     1       3.023  -3.259  -3.976  1.00  0.00           H  
HETATM   56  H   UNL     1       1.525  -2.449  -3.456  1.00  0.00           H  
HETATM   57  H   UNL     1       6.038  -2.158  -3.610  1.00  0.00           H  
HETATM   58  H   UNL     1       6.255  -3.268  -2.236  1.00  0.00           H  
HETATM   59  H   UNL     1       4.985  -3.583  -3.443  1.00  0.00           H  
HETATM   60  H   UNL     1       4.984   0.183   3.520  1.00  0.00           H  
HETATM   61  H   UNL     1       3.730   1.281   2.890  1.00  0.00           H  
HETATM   62  H   UNL     1       5.421   2.826   2.055  1.00  0.00           H  
HETATM   63  H   UNL     1       5.799   2.470   3.758  1.00  0.00           H  
HETATM   64  H   UNL     1      -0.349  -3.341   0.529  1.00  0.00           H  
HETATM   65  H   UNL     1      -2.320   1.107   0.867  1.00  0.00           H  
HETATM   66  H   UNL     1      -4.626   4.583  -0.743  1.00  0.00           H  
HETATM   67  H   UNL     1      -3.236   4.554  -1.855  1.00  0.00           H  
HETATM   68  H   UNL     1      -3.437   6.772  -0.785  1.00  0.00           H  
HETATM   69  H   UNL     1      -3.361   6.013   0.824  1.00  0.00           H  
HETATM   70  H   UNL     1      -1.294   4.904   1.525  1.00  0.00           H  
HETATM   71  H   UNL     1       0.096   4.875   0.413  1.00  0.00           H  
HETATM   72  H   UNL     1      -1.169   3.444  -1.154  1.00  0.00           H  
HETATM   73  H   UNL     1      -1.093   2.686   0.454  1.00  0.00           H  
HETATM   74  H   UNL     1      -5.527   1.179  -2.828  1.00  0.00           H  
HETATM   75  H   UNL     1      -4.856  -0.992  -1.895  1.00  0.00           H  
HETATM   76  H   UNL     1      -1.241   5.968  -1.224  1.00  0.00           H  
CONECT    1   38    2   41   42                                       
CONECT    2    1   34   43   44                                       
CONECT    3   13   13    4   15                                       
CONECT    4    3    5   45   46                                       
CONECT    5    4   40   47   48                                       
CONECT    6   20    7    7   49                                       
CONECT    7    6    6    8   21                                       
CONECT    8    9    9    7   50                                       
CONECT    9    8    8   10   51                                       
CONECT   10    9   11   11   52                                       
CONECT   11   10   10   21   53                                       
CONECT   12   13   54   55   56                                       
CONECT   13   12   32    3    3                                       
CONECT   14   32   57   58   59                                       
CONECT   15   33   33   16    3                                       
CONECT   16   15   34   39   39                                       
CONECT   17   34   18   60   61                                       
CONECT   18   17   38   62   63                                       
CONECT   19   40   20   20   22                                       
CONECT   20   19   19    6   64                                       
CONECT   21    7   22   22   11                                       
CONECT   22   21   21   23   19                                       
CONECT   23   22   24   24   31                                       
CONECT   24   23   23   25   65                                       
CONECT   25   24   35   37   37                                       
CONECT   26   35   27   66   67                                       
CONECT   27   26   36   68   69                                       
CONECT   28   36   29   70   71                                       
CONECT   29   28   35   72   73                                       
CONECT   30   37   31   31   74                                       
CONECT   31   30   30   23   75                                       
CONECT   32   14   33   13                                            
CONECT   33   32   15   15                                            
CONECT   34   17   16    2                                            
CONECT   35   26   25   29                                            
CONECT   36   27   28   76                                            
CONECT   37   25   25   30                                            
CONECT   38   18    1                                                 
CONECT   39   16   16                                                 
CONECT   40    5   19                                                 
CONECT   41    1                                                      
CONECT   42    1                                                      
CONECT   43    2                                                      
CONECT   44    2                                                      
CONECT   45    4                                                      
CONECT   46    4                                                      
CONECT   47    5                                                      
CONECT   48    5                                                      
CONECT   49    6                                                      
CONECT   50    8                                                      
CONECT   51    9                                                      
CONECT   52   10                                                      
CONECT   53   11                                                      
CONECT   54   12                                                      
CONECT   55   12                                                      
CONECT   56   12                                                      
CONECT   57   14                                                      
CONECT   58   14                                                      
CONECT   59   14                                                      
CONECT   60   17                                                      
CONECT   61   17                                                      
CONECT   62   18                                                      
CONECT   63   18                                                      
CONECT   64   20                                                      
CONECT   65   24                                                      
CONECT   66   26                                                      
CONECT   67   26                                                      
CONECT   68   27                                                      
CONECT   69   27                                                      
CONECT   70   28                                                      
CONECT   71   28                                                      
CONECT   72   29                                                      
CONECT   73   29                                                      
CONECT   74   30                                                      
CONECT   75   31                                                      
CONECT   76   36                                                      
MASTER        0    0    0    0    0    0    0    0   76    0   76    0
END
