COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.695   0.617  -0.507  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.593   0.589   0.387  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.189  -0.600  -1.001  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.270   1.849  -0.857  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.041  -0.660   0.724  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.085   1.791   0.900  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.362  -0.610  -1.947  1.00  0.00           C  
HETATM    8  N   UNL     1      -1.624  -1.730  -0.643  1.00  0.00           N  
HETATM    9  C   UNL     1      -1.755   3.003  -0.342  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.590  -1.784   0.186  1.00  0.00           C  
HETATM   11  C   UNL     1       1.134  -0.754   1.663  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.661   2.974   0.537  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.643  -0.708  -1.159  1.00  0.00           C  
HETATM   14  O   UNL     1      -2.307   4.196  -0.686  1.00  0.00           O  
HETATM   15  N   UNL     1       2.357  -0.349   0.958  1.00  0.00           N  
HETATM   16  O   UNL     1      -0.169   4.140   1.034  1.00  0.00           O  
HETATM   17  C   UNL     1      -5.173  -1.948  -0.854  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.285   0.443  -0.741  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.385   3.910  -1.579  1.00  0.00           C  
HETATM   20  C   UNL     1       3.371  -0.091   1.986  1.00  0.00           C  
HETATM   21  C   UNL     1       2.804  -1.514   0.187  1.00  0.00           C  
HETATM   22  C   UNL     1       0.925   3.796   1.886  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.347  -2.039  -0.124  1.00  0.00           C  
HETATM   24  C   UNL     1      -6.459   0.359  -0.017  1.00  0.00           C  
HETATM   25  C   UNL     1       4.684   0.332   1.325  1.00  0.00           C  
HETATM   26  C   UNL     1       4.086  -1.169  -0.574  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.996  -0.881   0.292  1.00  0.00           C  
HETATM   28  O   UNL     1      -6.869  -3.258   0.177  1.00  0.00           O  
HETATM   29  C   UNL     1       5.185  -0.805   0.429  1.00  0.00           C  
HETATM   30  O   UNL     1      -8.151  -0.965   1.004  1.00  0.00           O  
HETATM   31  C   UNL     1      -5.993  -4.234  -0.390  1.00  0.00           C  
HETATM   32  C   UNL     1       6.418  -0.357  -0.314  1.00  0.00           C  
HETATM   33  C   UNL     1      -8.563   0.375   1.283  1.00  0.00           C  
HETATM   34  C   UNL     1       7.616  -1.033  -0.141  1.00  0.00           C  
HETATM   35  C   UNL     1       6.356   0.731  -1.162  1.00  0.00           C  
HETATM   36  C   UNL     1       8.748  -0.621  -0.830  1.00  0.00           C  
HETATM   37  O   UNL     1       7.680  -2.104   0.693  1.00  0.00           O  
HETATM   38  C   UNL     1       7.486   1.143  -1.844  1.00  0.00           C  
HETATM   39  C   UNL     1       8.681   0.468  -1.678  1.00  0.00           C  
HETATM   40  C   UNL     1       9.025  -2.584   0.648  1.00  0.00           C  
HETATM   41  H   UNL     1      -3.112   1.884  -1.533  1.00  0.00           H  
HETATM   42  H   UNL     1       0.756   1.780   1.578  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.282  -1.466  -2.617  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.365   0.310  -2.532  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.172  -2.747   0.440  1.00  0.00           H  
HETATM   46  H   UNL     1       0.971  -0.094   2.516  1.00  0.00           H  
HETATM   47  H   UNL     1       1.239  -1.781   2.013  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.669  -2.845  -1.182  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.868   1.410  -0.981  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.115   3.276  -1.077  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.862   4.842  -1.884  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.001   3.394  -2.459  1.00  0.00           H  
HETATM   53  H   UNL     1       3.024   0.706   2.645  1.00  0.00           H  
HETATM   54  H   UNL     1       3.534  -0.997   2.570  1.00  0.00           H  
HETATM   55  H   UNL     1       2.997  -2.345   0.865  1.00  0.00           H  
HETATM   56  H   UNL     1       2.027  -1.799  -0.522  1.00  0.00           H  
HETATM   57  H   UNL     1       1.685   3.271   1.308  1.00  0.00           H  
HETATM   58  H   UNL     1       1.355   4.704   2.310  1.00  0.00           H  
HETATM   59  H   UNL     1       0.571   3.152   2.691  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.959   1.260   0.308  1.00  0.00           H  
HETATM   61  H   UNL     1       4.517   1.224   0.721  1.00  0.00           H  
HETATM   62  H   UNL     1       5.427   0.545   2.093  1.00  0.00           H  
HETATM   63  H   UNL     1       3.901  -0.323  -1.235  1.00  0.00           H  
HETATM   64  H   UNL     1       4.402  -2.030  -1.164  1.00  0.00           H  
HETATM   65  H   UNL     1       5.423  -1.675   1.042  1.00  0.00           H  
HETATM   66  H   UNL     1      -5.940  -4.091  -1.470  1.00  0.00           H  
HETATM   67  H   UNL     1      -4.998  -4.123   0.040  1.00  0.00           H  
HETATM   68  H   UNL     1      -6.373  -5.233  -0.174  1.00  0.00           H  
HETATM   69  H   UNL     1      -7.789   0.880   1.861  1.00  0.00           H  
HETATM   70  H   UNL     1      -8.724   0.908   0.347  1.00  0.00           H  
HETATM   71  H   UNL     1      -9.490   0.358   1.856  1.00  0.00           H  
HETATM   72  H   UNL     1       5.424   1.261  -1.294  1.00  0.00           H  
HETATM   73  H   UNL     1       9.681  -1.149  -0.701  1.00  0.00           H  
HETATM   74  H   UNL     1       7.435   1.994  -2.507  1.00  0.00           H  
HETATM   75  H   UNL     1       9.562   0.791  -2.211  1.00  0.00           H  
HETATM   76  H   UNL     1       9.273  -2.874  -0.373  1.00  0.00           H  
HETATM   77  H   UNL     1       9.703  -1.796   0.977  1.00  0.00           H  
HETATM   78  H   UNL     1       9.125  -3.447   1.306  1.00  0.00           H  
CONECT    1    2    3    4    4                                       
CONECT    2    1    5    6    6                                       
CONECT    3    1    7    8    8                                       
CONECT    4    1    1    9   41                                       
CONECT    5    2   10   10   11                                       
CONECT    6    2    2   12   42                                       
CONECT    7    3   13   43   44                                       
CONECT    8    3    3   10                                            
CONECT    9    4   12   12   14                                       
CONECT   10    5    5    8   45                                       
CONECT   11    5   15   46   47                                       
CONECT   12    6    9    9   16                                       
CONECT   13    7   17   18   18                                       
CONECT   14    9   19                                                 
CONECT   15   11   20   21                                            
CONECT   16   12   22                                                 
CONECT   17   13   23   23   48                                       
CONECT   18   13   13   24   49                                       
CONECT   19   14   50   51   52                                       
CONECT   20   15   25   53   54                                       
CONECT   21   15   26   55   56                                       
CONECT   22   16   57   58   59                                       
CONECT   23   17   17   27   28                                       
CONECT   24   18   27   27   60                                       
CONECT   25   20   29   61   62                                       
CONECT   26   21   29   63   64                                       
CONECT   27   23   24   24   30                                       
CONECT   28   23   31                                                 
CONECT   29   25   26   32   65                                       
CONECT   30   27   33                                                 
CONECT   31   28   66   67   68                                       
CONECT   32   29   34   35   35                                       
CONECT   33   30   69   70   71                                       
CONECT   34   32   36   36   37                                       
CONECT   35   32   32   38   72                                       
CONECT   36   34   34   39   73                                       
CONECT   37   34   40                                                 
CONECT   38   35   39   39   74                                       
CONECT   39   36   38   38   75                                       
CONECT   40   37   76   77   78                                       
CONECT   41    4                                                      
CONECT   42    6                                                      
CONECT   43    7                                                      
CONECT   44    7                                                      
CONECT   45   10                                                      
CONECT   46   11                                                      
CONECT   47   11                                                      
CONECT   48   17                                                      
CONECT   49   18                                                      
CONECT   50   19                                                      
CONECT   51   19                                                      
CONECT   52   19                                                      
CONECT   53   20                                                      
CONECT   54   20                                                      
CONECT   55   21                                                      
CONECT   56   21                                                      
CONECT   57   22                                                      
CONECT   58   22                                                      
CONECT   59   22                                                      
CONECT   60   24                                                      
CONECT   61   25                                                      
CONECT   62   25                                                      
CONECT   63   26                                                      
CONECT   64   26                                                      
CONECT   65   29                                                      
CONECT   66   31                                                      
CONECT   67   31                                                      
CONECT   68   31                                                      
CONECT   69   33                                                      
CONECT   70   33                                                      
CONECT   71   33                                                      
CONECT   72   35                                                      
CONECT   73   36                                                      
CONECT   74   38                                                      
CONECT   75   39                                                      
CONECT   76   40                                                      
CONECT   77   40                                                      
CONECT   78   40                                                      
MASTER        0    0    0    0    0    0    0    0   78    0   78    0
END
