COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       9.965   0.687   0.624  1.00  0.00           C  
HETATM    2  C   UNL     1       7.637   0.468  -0.061  1.00  0.00           C  
HETATM    3  O   UNL     1       7.705   1.583  -0.542  1.00  0.00           O  
HETATM    4  C   UNL     1       5.120  -2.286   0.335  1.00  0.00           C  
HETATM    5  C   UNL     1       4.009  -1.728  -0.291  1.00  0.00           C  
HETATM    6  C   UNL     1       1.637  -1.809  -0.267  1.00  0.00           C  
HETATM    7  C   UNL     1       0.377  -2.583  -0.243  1.00  0.00           C  
HETATM    8  C   UNL     1       0.411  -3.977  -0.317  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.765  -4.700  -0.294  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.980  -4.050  -0.198  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.027  -2.659  -0.124  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.479  -2.695  -0.002  1.00  0.00           C  
HETATM   13  C   UNL     1      -6.977  -2.500   0.131  1.00  0.00           C  
HETATM   14  C   UNL     1      -7.768  -1.406   0.231  1.00  0.00           C  
HETATM   15  N   UNL     1      -6.992  -0.322   0.254  1.00  0.00           N  
HETATM   16  C   UNL     1      -5.727  -0.692   0.171  1.00  0.00           C  
HETATM   17  N   UNL     1      -4.514   1.414   0.207  1.00  0.00           N  
HETATM   18  C   UNL     1      -3.307   2.118   0.287  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.913   3.507   0.447  1.00  0.00           C  
HETATM   20  C   UNL     1       1.332   3.557   1.232  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.995   4.061  -0.231  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.028   5.790  -1.496  1.00  0.00           C  
HETATM   23  N   UNL     1       8.714  -0.071   0.545  1.00  0.00           N  
HETATM   24  C   UNL     1       6.376  -0.295  -0.141  1.00  0.00           C  
HETATM   25  C   UNL     1       6.297  -1.576   0.412  1.00  0.00           C  
HETATM   26  N   UNL     1       2.819  -2.448  -0.367  1.00  0.00           N  
HETATM   27  O   UNL     1       1.606  -0.596  -0.198  1.00  0.00           O  
HETATM   28  C   UNL     1      -0.846  -1.923  -0.140  1.00  0.00           C  
HETATM   29  C   UNL     1      -3.334  -1.964  -0.022  1.00  0.00           C  
HETATM   30  N   UNL     1      -5.689  -2.061   0.093  1.00  0.00           N  
HETATM   31  C   UNL     1      -4.506   0.030   0.142  1.00  0.00           C  
HETATM   32  C   UNL     1      -2.224   1.566   0.959  1.00  0.00           C  
HETATM   33  C   UNL     1      -1.031   2.260   1.038  1.00  0.00           C  
HETATM   34  O   UNL     1       0.262   4.188   0.525  1.00  0.00           O  
HETATM   35  O   UNL     1      -1.878   5.283  -0.816  1.00  0.00           O  
HETATM   36  C   UNL     1      -3.190   3.366  -0.311  1.00  0.00           C  
HETATM   37  N   UNL     1      -3.365  -0.622   0.050  1.00  0.00           N  
HETATM   38  C   UNL     1       4.085  -0.452  -0.842  1.00  0.00           C  
HETATM   39  C   UNL     1       5.259   0.262  -0.769  1.00  0.00           C  
HETATM   40  H   UNL     1      10.316   0.914  -0.382  1.00  0.00           H  
HETATM   41  H   UNL     1       9.794   1.615   1.169  1.00  0.00           H  
HETATM   42  H   UNL     1      10.717   0.094   1.146  1.00  0.00           H  
HETATM   43  H   UNL     1       5.057  -3.274   0.765  1.00  0.00           H  
HETATM   44  H   UNL     1       1.358  -4.490  -0.392  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.734  -5.778  -0.352  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.896  -4.622  -0.182  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.436  -3.772  -0.064  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.306  -3.528   0.090  1.00  0.00           H  
HETATM   49  H   UNL     1      -8.847  -1.410   0.284  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.356   1.895   0.198  1.00  0.00           H  
HETATM   51  H   UNL     1       1.029   3.376   2.263  1.00  0.00           H  
HETATM   52  H   UNL     1       1.575   2.609   0.752  1.00  0.00           H  
HETATM   53  H   UNL     1       2.208   4.205   1.219  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.800   6.769  -1.916  1.00  0.00           H  
HETATM   55  H   UNL     1      -3.306   5.106  -2.299  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.856   5.880  -0.793  1.00  0.00           H  
HETATM   57  H   UNL     1       8.660  -0.960   0.929  1.00  0.00           H  
HETATM   58  H   UNL     1       7.159  -2.010   0.898  1.00  0.00           H  
HETATM   59  H   UNL     1       2.841  -3.410  -0.491  1.00  0.00           H  
HETATM   60  H   UNL     1      -0.878  -0.845  -0.077  1.00  0.00           H  
HETATM   61  H   UNL     1      -2.315   0.594   1.420  1.00  0.00           H  
HETATM   62  H   UNL     1      -0.190   1.829   1.561  1.00  0.00           H  
HETATM   63  H   UNL     1      -4.030   3.795  -0.836  1.00  0.00           H  
HETATM   64  H   UNL     1       3.221  -0.023  -1.328  1.00  0.00           H  
HETATM   65  H   UNL     1       5.317   1.252  -1.197  1.00  0.00           H  
CONECT    1   23   40   41   42                                       
CONECT    2   24   23    3    3                                       
CONECT    3    2    2                                                 
CONECT    4   25   25    5   43                                       
CONECT    5    4   26   38   38                                       
CONECT    6   27   27    7   26                                       
CONECT    7    8    6   28   28                                       
CONECT    8    9    9    7   44                                       
CONECT    9    8    8   10   45                                       
CONECT   10    9   11   11   46                                       
CONECT   11   10   10   28   29                                       
CONECT   12   29   29   30   47                                       
CONECT   13   30   14   14   48                                       
CONECT   14   13   13   15   49                                       
CONECT   15   16   16   14                                            
CONECT   16   30   31   15   15                                       
CONECT   17   31   18   50                                            
CONECT   18   36   17   32   32                                       
CONECT   19   21   34   33   33                                       
CONECT   20   34   51   52   53                                       
CONECT   21   35   36   36   19                                       
CONECT   22   35   54   55   56                                       
CONECT   23    2    1   57                                            
CONECT   24   25   39   39    2                                       
CONECT   25    4    4   24   58                                       
CONECT   26    6    5   59                                            
CONECT   27    6    6                                                 
CONECT   28    7    7   11   60                                       
CONECT   29   11   12   12   37                                       
CONECT   30   12   13   16                                            
CONECT   31   37   37   16   17                                       
CONECT   32   18   18   33   61                                       
CONECT   33   19   19   32   62                                       
CONECT   34   19   20                                                 
CONECT   35   22   21                                                 
CONECT   36   21   21   18   63                                       
CONECT   37   29   31   31                                            
CONECT   38    5    5   39   64                                       
CONECT   39   24   24   38   65                                       
CONECT   40    1                                                      
CONECT   41    1                                                      
CONECT   42    1                                                      
CONECT   43    4                                                      
CONECT   44    8                                                      
CONECT   45    9                                                      
CONECT   46   10                                                      
CONECT   47   12                                                      
CONECT   48   13                                                      
CONECT   49   14                                                      
CONECT   50   17                                                      
CONECT   51   20                                                      
CONECT   52   20                                                      
CONECT   53   20                                                      
CONECT   54   22                                                      
CONECT   55   22                                                      
CONECT   56   22                                                      
CONECT   57   23                                                      
CONECT   58   25                                                      
CONECT   59   26                                                      
CONECT   60   28                                                      
CONECT   61   32                                                      
CONECT   62   33                                                      
CONECT   63   36                                                      
CONECT   64   38                                                      
CONECT   65   39                                                      
MASTER        0    0    0    0    0    0    0    0   65    0   65    0
END
