COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -3.826   4.091   2.985  1.00  0.00           N  
HETATM    2  C   UNL     1      -2.655   3.315   3.026  1.00  0.00           C  
HETATM    3  N   UNL     1      -2.313   2.657   4.159  1.00  0.00           N  
HETATM    4  C   UNL     1      -1.173   1.925   4.138  1.00  0.00           C  
HETATM    5  N   UNL     1      -0.299   1.747   3.123  1.00  0.00           N  
HETATM    6  C   UNL     1      -0.699   2.425   2.036  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.833   3.210   1.908  1.00  0.00           C  
HETATM    8  N   UNL     1      -1.913   3.746   0.647  1.00  0.00           N  
HETATM    9  C   UNL     1      -0.847   3.294   0.021  1.00  0.00           C  
HETATM   10  N   UNL     1      -0.077   2.488   0.819  1.00  0.00           N  
HETATM   11  C   UNL     1       1.171   1.827   0.433  1.00  0.00           C  
HETATM   12  C   UNL     1       0.970   0.461  -0.212  1.00  0.00           C  
HETATM   13  O   UNL     1       1.879   2.654  -0.508  1.00  0.00           O  
HETATM   14  C   UNL     1       2.219   1.846  -1.646  1.00  0.00           C  
HETATM   15  C   UNL     1       2.240   2.706  -2.896  1.00  0.00           C  
HETATM   16  O   UNL     1       0.966   3.305  -3.056  1.00  0.00           O  
HETATM   17  P   UNL     1       0.684   4.285  -4.313  1.00  0.00           P  
HETATM   18  O   UNL     1      -0.704   4.855  -4.367  1.00  0.00           O  
HETATM   19  O   UNL     1       1.858   5.395  -4.230  1.00  0.00           O  
HETATM   20  O   UNL     1       1.092   3.410  -5.610  1.00  0.00           O  
HETATM   21  P   UNL     1       0.436   2.073  -6.236  1.00  0.00           P  
HETATM   22  O   UNL     1       0.423   0.890  -5.313  1.00  0.00           O  
HETATM   23  O   UNL     1       1.263   1.867  -7.609  1.00  0.00           O  
HETATM   24  O   UNL     1      -1.016   2.571  -6.741  1.00  0.00           O  
HETATM   25  C   UNL     1       1.177   0.741  -1.684  1.00  0.00           C  
HETATM   26  O   UNL     1       1.636  -0.408  -2.366  1.00  0.00           O  
HETATM   27  C   UNL     1       0.794  -1.477  -2.361  1.00  0.00           C  
HETATM   28  O   UNL     1      -0.310  -1.540  -1.829  1.00  0.00           O  
HETATM   29  C   UNL     1       1.407  -2.570  -3.097  1.00  0.00           C  
HETATM   30  C   UNL     1       2.730  -2.730  -3.155  1.00  0.00           C  
HETATM   31  C   UNL     1       3.076  -3.963  -3.944  1.00  0.00           C  
HETATM   32  C   UNL     1       3.563  -5.072  -2.992  1.00  0.00           C  
HETATM   33  C   UNL     1       4.214  -3.684  -4.944  1.00  0.00           C  
HETATM   34  N   UNL     1       1.771  -4.406  -4.561  1.00  0.00           N  
HETATM   35  O   UNL     1       1.769  -3.934  -5.941  1.00  0.00           O  
HETATM   36  C   UNL     1       0.676  -3.658  -3.830  1.00  0.00           C  
HETATM   37  C   UNL     1       0.027  -4.634  -2.828  1.00  0.00           C  
HETATM   38  C   UNL     1      -0.448  -3.121  -4.741  1.00  0.00           C  
HETATM   39  H   UNL     1      -4.719   3.638   3.033  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.758   5.076   2.815  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.929   1.412   5.062  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.579   3.514  -1.004  1.00  0.00           H  
HETATM   43  H   UNL     1       1.753   1.756   1.357  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.002   0.004   0.001  1.00  0.00           H  
HETATM   45  H   UNL     1       1.736  -0.240   0.147  1.00  0.00           H  
HETATM   46  H   UNL     1       3.224   1.436  -1.487  1.00  0.00           H  
HETATM   47  H   UNL     1       2.459   2.091  -3.771  1.00  0.00           H  
HETATM   48  H   UNL     1       2.994   3.488  -2.801  1.00  0.00           H  
HETATM   49  H   UNL     1       0.241   1.086  -2.140  1.00  0.00           H  
HETATM   50  H   UNL     1       3.459  -2.090  -2.676  1.00  0.00           H  
HETATM   51  H   UNL     1       4.055  -4.639  -2.116  1.00  0.00           H  
HETATM   52  H   UNL     1       2.721  -5.681  -2.648  1.00  0.00           H  
HETATM   53  H   UNL     1       4.277  -5.728  -3.499  1.00  0.00           H  
HETATM   54  H   UNL     1       4.364  -2.607  -5.065  1.00  0.00           H  
HETATM   55  H   UNL     1       5.152  -4.125  -4.593  1.00  0.00           H  
HETATM   56  H   UNL     1       3.979  -4.111  -5.924  1.00  0.00           H  
HETATM   57  H   UNL     1       1.414  -3.036  -5.813  1.00  0.00           H  
HETATM   58  H   UNL     1      -0.819  -5.152  -3.289  1.00  0.00           H  
HETATM   59  H   UNL     1       0.752  -5.385  -2.498  1.00  0.00           H  
HETATM   60  H   UNL     1      -0.337  -4.096  -1.948  1.00  0.00           H  
HETATM   61  H   UNL     1      -0.834  -3.917  -5.385  1.00  0.00           H  
HETATM   62  H   UNL     1      -1.275  -2.731  -4.142  1.00  0.00           H  
HETATM   63  H   UNL     1      -0.074  -2.315  -5.379  1.00  0.00           H  
HETATM   64  H   UNL     1       1.108   1.057  -8.140  1.00  0.00           H  
HETATM   65  H   UNL     1      -1.648   1.910  -7.097  1.00  0.00           H  
HETATM   66  H   UNL     1       1.763   6.140  -3.599  1.00  0.00           H  
CONECT    1    2   39   40                                            
CONECT    2    1    3    3    7                                       
CONECT    3    2    2    4                                            
CONECT    4    3    5    5   41                                       
CONECT    5    4    4    6                                            
CONECT    6    5    7    7   10                                       
CONECT    7    2    6    6    8                                       
CONECT    8    7    9    9                                            
CONECT    9    8    8   10   42                                       
CONECT   10    6    9   11                                            
CONECT   11   10   12   13   43                                       
CONECT   12   11   25   44   45                                       
CONECT   13   11   14                                                 
CONECT   14   13   15   25   46                                       
CONECT   15   14   16   47   48                                       
CONECT   16   15   17                                                 
CONECT   17   16   18   18   19                                       
CONECT   17   20                                                      
CONECT   18   17   17                                                 
CONECT   19   17   66                                                 
CONECT   20   17   21                                                 
CONECT   21   20   22   22   23                                       
CONECT   21   24                                                      
CONECT   22   21   21                                                 
CONECT   23   21   64                                                 
CONECT   24   21   65                                                 
CONECT   25   12   14   26   49                                       
CONECT   26   25   27                                                 
CONECT   27   26   28   28   29                                       
CONECT   28   27   27                                                 
CONECT   29   27   30   30   36                                       
CONECT   30   29   29   31   50                                       
CONECT   31   30   32   33   34                                       
CONECT   32   31   51   52   53                                       
CONECT   33   31   54   55   56                                       
CONECT   34   31   35   36                                            
CONECT   35   34   57                                                 
CONECT   36   29   34   37   38                                       
CONECT   37   36   58   59   60                                       
CONECT   38   36   61   62   63                                       
CONECT   39    1                                                      
CONECT   40    1                                                      
CONECT   41    4                                                      
CONECT   42    9                                                      
CONECT   43   11                                                      
CONECT   44   12                                                      
CONECT   45   12                                                      
CONECT   46   14                                                      
CONECT   47   15                                                      
CONECT   48   15                                                      
CONECT   49   25                                                      
CONECT   50   30                                                      
CONECT   51   32                                                      
CONECT   52   32                                                      
CONECT   53   32                                                      
CONECT   54   33                                                      
CONECT   55   33                                                      
CONECT   56   33                                                      
CONECT   57   35                                                      
CONECT   58   37                                                      
CONECT   59   37                                                      
CONECT   60   37                                                      
CONECT   61   38                                                      
CONECT   62   38                                                      
CONECT   63   38                                                      
CONECT   64   23                                                      
CONECT   65   24                                                      
CONECT   66   19                                                      
MASTER        0    0    0    0    0    0    0    0   66    0   66    0
END
