COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -6.808   4.179   0.956  1.00  0.00           O  
HETATM    2  C   UNL     1      -5.768   4.363   0.359  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.083   5.703   0.434  1.00  0.00           C  
HETATM    4  N   UNL     1      -5.221   3.367  -0.366  1.00  0.00           N  
HETATM    5  C   UNL     1      -5.884   2.062  -0.434  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.469   1.214   0.771  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.933   1.896   2.059  1.00  0.00           C  
HETATM    8  O   UNL     1      -6.070  -0.079   0.672  1.00  0.00           O  
HETATM    9  C   UNL     1      -5.469   1.344  -1.722  1.00  0.00           C  
HETATM   10  O   UNL     1      -5.918   2.093  -2.853  1.00  0.00           O  
HETATM   11  C   UNL     1      -6.105  -0.049  -1.744  1.00  0.00           C  
HETATM   12  O   UNL     1      -7.529   0.076  -1.769  1.00  0.00           O  
HETATM   13  C   UNL     1      -5.681  -0.816  -0.488  1.00  0.00           C  
HETATM   14  O   UNL     1      -4.263  -0.987  -0.491  1.00  0.00           O  
HETATM   15  P   UNL     1      -3.530  -2.247   0.193  1.00  0.00           P  
HETATM   16  O   UNL     1      -3.942  -3.595  -0.586  1.00  0.00           O  
HETATM   17  O   UNL     1      -3.946  -2.350   1.610  1.00  0.00           O  
HETATM   18  O   UNL     1      -1.935  -2.049   0.114  1.00  0.00           O  
HETATM   19  P   UNL     1      -0.683  -2.747   0.848  1.00  0.00           P  
HETATM   20  O   UNL     1      -0.870  -4.215   0.852  1.00  0.00           O  
HETATM   21  O   UNL     1      -0.584  -2.214   2.364  1.00  0.00           O  
HETATM   22  O   UNL     1       0.673  -2.381   0.061  1.00  0.00           O  
HETATM   23  C   UNL     1       1.945  -2.934   0.403  1.00  0.00           C  
HETATM   24  C   UNL     1       3.014  -2.378  -0.540  1.00  0.00           C  
HETATM   25  O   UNL     1       3.177  -0.967  -0.316  1.00  0.00           O  
HETATM   26  C   UNL     1       4.370  -3.049  -0.249  1.00  0.00           C  
HETATM   27  O   UNL     1       4.847  -3.737  -1.407  1.00  0.00           O  
HETATM   28  C   UNL     1       5.308  -1.869   0.105  1.00  0.00           C  
HETATM   29  O   UNL     1       6.598  -2.049  -0.483  1.00  0.00           O  
HETATM   30  C   UNL     1       4.572  -0.665  -0.535  1.00  0.00           C  
HETATM   31  N   UNL     1       4.941   0.583   0.138  1.00  0.00           N  
HETATM   32  C   UNL     1       4.260   1.183   1.157  1.00  0.00           C  
HETATM   33  N   UNL     1       4.871   2.274   1.513  1.00  0.00           N  
HETATM   34  C   UNL     1       6.036   1.357  -0.137  1.00  0.00           C  
HETATM   35  C   UNL     1       5.976   2.441   0.747  1.00  0.00           C  
HETATM   36  N   UNL     1       7.045   1.270  -1.012  1.00  0.00           N  
HETATM   37  C   UNL     1       7.987   2.185  -1.055  1.00  0.00           C  
HETATM   38  N   UNL     1       9.002   2.053  -1.969  1.00  0.00           N  
HETATM   39  N   UNL     1       7.986   3.261  -0.218  1.00  0.00           N  
HETATM   40  C   UNL     1       6.997   3.419   0.689  1.00  0.00           C  
HETATM   41  O   UNL     1       6.985   4.379   1.440  1.00  0.00           O  
HETATM   42  H   UNL     1      -5.666   6.374   1.065  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.087   5.579   0.859  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.001   6.126  -0.567  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.390   3.514  -0.843  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.965   2.201  -0.426  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.384   1.110   0.785  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.018   1.999   2.045  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.637   1.292   2.917  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.475   2.882   2.134  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.383   1.249  -1.753  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.694   1.691  -3.704  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.771  -0.589  -2.630  1.00  0.00           H  
HETATM   54  H   UNL     1      -7.998  -0.769  -1.784  1.00  0.00           H  
HETATM   55  H   UNL     1      -6.166  -1.792  -0.478  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.700  -3.598  -1.522  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.460  -1.258   2.437  1.00  0.00           H  
HETATM   58  H   UNL     1       2.193  -2.667   1.431  1.00  0.00           H  
HETATM   59  H   UNL     1       1.907  -4.019   0.309  1.00  0.00           H  
HETATM   60  H   UNL     1       2.724  -2.557  -1.575  1.00  0.00           H  
HETATM   61  H   UNL     1       4.284  -3.734   0.594  1.00  0.00           H  
HETATM   62  H   UNL     1       5.724  -4.129  -1.298  1.00  0.00           H  
HETATM   63  H   UNL     1       5.388  -1.746   1.185  1.00  0.00           H  
HETATM   64  H   UNL     1       7.061  -2.842  -0.179  1.00  0.00           H  
HETATM   65  H   UNL     1       4.789  -0.606  -1.602  1.00  0.00           H  
HETATM   66  H   UNL     1       3.350   0.807   1.601  1.00  0.00           H  
HETATM   67  H   UNL     1       9.016   1.293  -2.572  1.00  0.00           H  
HETATM   68  H   UNL     1       9.705   2.721  -2.013  1.00  0.00           H  
HETATM   69  H   UNL     1       8.697   3.918  -0.276  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    3    4    1    1                                       
CONECT    3    2   42   43   44                                       
CONECT    4    2    5   45                                            
CONECT    5    9    4    6   46                                       
CONECT    6    5    8    7   47                                       
CONECT    7    6   48   49   50                                       
CONECT    8   13    6                                                 
CONECT    9   10   11    5   51                                       
CONECT   10    9   52                                                 
CONECT   11    9   13   12   53                                       
CONECT   12   11   54                                                 
CONECT   13   14   11    8   55                                       
CONECT   14   15   13                                                 
CONECT   15   17   17   18   14                                       
CONECT   15   16                                                      
CONECT   16   15   56                                                 
CONECT   17   15   15                                                 
CONECT   18   19   15                                                 
CONECT   19   20   20   22   21                                       
CONECT   19   18                                                      
CONECT   20   19   19                                                 
CONECT   21   19   57                                                 
CONECT   22   19   23                                                 
CONECT   23   24   22   58   59                                       
CONECT   24   26   25   23   60                                       
CONECT   25   24   30                                                 
CONECT   26   27   28   24   61                                       
CONECT   27   26   62                                                 
CONECT   28   29   26   30   63                                       
CONECT   29   28   64                                                 
CONECT   30   28   25   31   65                                       
CONECT   31   30   34   32                                            
CONECT   32   31   33   33   66                                       
CONECT   33   32   32   35                                            
CONECT   34   36   31   35   35                                       
CONECT   35   34   34   40   33                                       
CONECT   36   37   37   34                                            
CONECT   37   38   36   36   39                                       
CONECT   38   37   67   68                                            
CONECT   39   37   40   69                                            
CONECT   40   39   35   41   41                                       
CONECT   41   40   40                                                 
CONECT   42    3                                                      
CONECT   43    3                                                      
CONECT   44    3                                                      
CONECT   45    4                                                      
CONECT   46    5                                                      
CONECT   47    6                                                      
CONECT   48    7                                                      
CONECT   49    7                                                      
CONECT   50    7                                                      
CONECT   51    9                                                      
CONECT   52   10                                                      
CONECT   53   11                                                      
CONECT   54   12                                                      
CONECT   55   13                                                      
CONECT   56   16                                                      
CONECT   57   21                                                      
CONECT   58   23                                                      
CONECT   59   23                                                      
CONECT   60   24                                                      
CONECT   61   26                                                      
CONECT   62   27                                                      
CONECT   63   28                                                      
CONECT   64   29                                                      
CONECT   65   30                                                      
CONECT   66   32                                                      
CONECT   67   38                                                      
CONECT   68   38                                                      
CONECT   69   39                                                      
MASTER        0    0    0    0    0    0    0    0   69    0   69    0
END
