COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  P   UNL     1      -0.289  -0.971   1.320  1.00  0.00           P  
HETATM    2  N   UNL     1       5.797   0.581  -0.666  1.00  0.00           N  
HETATM    3  C   UNL     1       5.797   0.877   0.646  1.00  0.00           C  
HETATM    4  O   UNL     1       5.099   0.229   1.408  1.00  0.00           O  
HETATM    5  N   UNL     1       6.548   1.866   1.128  1.00  0.00           N  
HETATM    6  C   UNL     1       7.317   2.587   0.321  1.00  0.00           C  
HETATM    7  N   UNL     1       8.089   3.606   0.830  1.00  0.00           N  
HETATM    8  C   UNL     1       7.339   2.303  -1.059  1.00  0.00           C  
HETATM    9  C   UNL     1       6.574   1.290  -1.533  1.00  0.00           C  
HETATM   10  C   UNL     1       4.961  -0.513  -1.166  1.00  0.00           C  
HETATM   11  O   UNL     1      -1.293   0.223   0.920  1.00  0.00           O  
HETATM   12  C   UNL     1       5.439  -1.872  -0.593  1.00  0.00           C  
HETATM   13  O   UNL     1       6.478  -2.428  -1.401  1.00  0.00           O  
HETATM   14  O   UNL     1      -1.083  -2.371   1.289  1.00  0.00           O  
HETATM   15  C   UNL     1       4.154  -2.730  -0.677  1.00  0.00           C  
HETATM   16  O   UNL     1       4.171  -3.542  -1.853  1.00  0.00           O  
HETATM   17  O   UNL     1       0.241  -0.734   2.681  1.00  0.00           O  
HETATM   18  C   UNL     1       3.013  -1.696  -0.752  1.00  0.00           C  
HETATM   19  O   UNL     1       3.612  -0.392  -0.665  1.00  0.00           O  
HETATM   20  C   UNL     1       2.043  -1.906   0.412  1.00  0.00           C  
HETATM   21  O   UNL     1       0.930  -1.022   0.270  1.00  0.00           O  
HETATM   22  H   UNL     1       8.072   3.799   1.780  1.00  0.00           H  
HETATM   23  H   UNL     1       8.649   4.131   0.238  1.00  0.00           H  
HETATM   24  H   UNL     1       7.959   2.880  -1.729  1.00  0.00           H  
HETATM   25  H   UNL     1       6.574   1.052  -2.586  1.00  0.00           H  
HETATM   26  H   UNL     1       4.967  -0.533  -2.256  1.00  0.00           H  
HETATM   27  C   UNL     1      -2.419   0.593   1.717  1.00  0.00           C  
HETATM   28  H   UNL     1       5.768  -1.763   0.441  1.00  0.00           H  
HETATM   29  H   UNL     1       6.811  -3.279  -1.083  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.459  -2.592   0.426  1.00  0.00           H  
HETATM   31  H   UNL     1       4.050  -3.351   0.213  1.00  0.00           H  
HETATM   32  H   UNL     1       4.904  -4.172  -1.885  1.00  0.00           H  
HETATM   33  H   UNL     1       2.483  -1.798  -1.699  1.00  0.00           H  
HETATM   34  H   UNL     1       1.691  -2.937   0.410  1.00  0.00           H  
HETATM   35  H   UNL     1       2.554  -1.699   1.352  1.00  0.00           H  
HETATM   36  O   UNL     1      -3.563  -0.157   1.304  1.00  0.00           O  
HETATM   37  C   UNL     1      -3.915   0.026  -0.070  1.00  0.00           C  
HETATM   38  C   UNL     1      -4.255   1.498  -0.317  1.00  0.00           C  
HETATM   39  C   UNL     1      -3.056   2.365   0.078  1.00  0.00           C  
HETATM   40  C   UNL     1      -2.700   2.088   1.542  1.00  0.00           C  
HETATM   41  F   UNL     1      -3.770   2.462   2.362  1.00  0.00           F  
HETATM   42  O   UNL     1      -3.391   3.745  -0.080  1.00  0.00           O  
HETATM   43  N   UNL     1      -4.559   1.698  -1.736  1.00  0.00           N  
HETATM   44  C   UNL     1      -5.346   2.723  -2.118  1.00  0.00           C  
HETATM   45  O   UNL     1      -5.804   3.479  -1.288  1.00  0.00           O  
HETATM   46  C   UNL     1      -5.658   2.930  -3.578  1.00  0.00           C  
HETATM   47  C   UNL     1      -5.129  -0.842  -0.405  1.00  0.00           C  
HETATM   48  C   UNL     1      -4.832  -2.298  -0.039  1.00  0.00           C  
HETATM   49  C   UNL     1      -6.046  -3.166  -0.375  1.00  0.00           C  
HETATM   50  O   UNL     1      -5.814  -4.503   0.073  1.00  0.00           O  
HETATM   51  O   UNL     1      -3.700  -2.754  -0.783  1.00  0.00           O  
HETATM   52  O   UNL     1      -6.261  -0.386   0.339  1.00  0.00           O  
HETATM   53  H   UNL     1      -2.207   0.384   2.766  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.075  -0.264  -0.701  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.121   1.777   0.285  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.204   2.120  -0.557  1.00  0.00           H  
HETATM   57  H   UNL     1      -1.813   2.660   1.816  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.676   4.352   0.153  1.00  0.00           H  
HETATM   59  H   UNL     1      -4.193   1.094  -2.400  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.165   2.048  -3.970  1.00  0.00           H  
HETATM   61  H   UNL     1      -6.304   3.800  -3.692  1.00  0.00           H  
HETATM   62  H   UNL     1      -4.731   3.090  -4.128  1.00  0.00           H  
HETATM   63  H   UNL     1      -5.343  -0.772  -1.472  1.00  0.00           H  
HETATM   64  H   UNL     1      -4.618  -2.369   1.027  1.00  0.00           H  
HETATM   65  H   UNL     1      -6.929  -2.765   0.123  1.00  0.00           H  
HETATM   66  H   UNL     1      -6.206  -3.167  -1.453  1.00  0.00           H  
HETATM   67  H   UNL     1      -6.545  -5.111  -0.107  1.00  0.00           H  
HETATM   68  H   UNL     1      -3.820  -2.720  -1.742  1.00  0.00           H  
HETATM   69  H   UNL     1      -6.141  -0.421   1.298  1.00  0.00           H  
CONECT    1   14   21   11   17                                       
CONECT    1   17                                                      
CONECT    2    3   10    9                                            
CONECT    3    2    4    4    5                                       
CONECT    4    3    3                                                 
CONECT    5    3    6    6                                            
CONECT    6    5    5    7    8                                       
CONECT    7    6   22   23                                            
CONECT    8    6    9    9   24                                       
CONECT    9    8    8    2   25                                       
CONECT   10    2   12   26   19                                       
CONECT   11    1   27                                                 
CONECT   12   10   15   13   28                                       
CONECT   13   12   29                                                 
CONECT   14    1   30                                                 
CONECT   15   12   16   31   18                                       
CONECT   16   15   32                                                 
CONECT   17    1    1                                                 
CONECT   18   15   33   19   20                                       
CONECT   19   10   18                                                 
CONECT   20   18   34   35   21                                       
CONECT   21    1   20                                                 
CONECT   22    7                                                      
CONECT   23    7                                                      
CONECT   24    8                                                      
CONECT   25    9                                                      
CONECT   26   10                                                      
CONECT   27   11   36   40   53                                       
CONECT   28   12                                                      
CONECT   29   13                                                      
CONECT   30   14                                                      
CONECT   31   15                                                      
CONECT   32   16                                                      
CONECT   33   18                                                      
CONECT   34   20                                                      
CONECT   35   20                                                      
CONECT   36   27   37                                                 
CONECT   37   36   38   47   54                                       
CONECT   38   37   39   43   55                                       
CONECT   39   38   40   42   56                                       
CONECT   40   27   39   41   57                                       
CONECT   41   40                                                      
CONECT   42   39   58                                                 
CONECT   43   38   44   59                                            
CONECT   44   43   45   45   46                                       
CONECT   45   44   44                                                 
CONECT   46   44   60   61   62                                       
CONECT   47   37   48   52   63                                       
CONECT   48   47   49   51   64                                       
CONECT   49   48   50   65   66                                       
CONECT   50   49   67                                                 
CONECT   51   48   68                                                 
CONECT   52   47   69                                                 
CONECT   53   27                                                      
CONECT   54   37                                                      
CONECT   55   38                                                      
CONECT   56   39                                                      
CONECT   57   40                                                      
CONECT   58   42                                                      
CONECT   59   43                                                      
CONECT   60   46                                                      
CONECT   61   46                                                      
CONECT   62   46                                                      
CONECT   63   47                                                      
CONECT   64   48                                                      
CONECT   65   49                                                      
CONECT   66   49                                                      
CONECT   67   50                                                      
CONECT   68   51                                                      
CONECT   69   52                                                      
MASTER        0    0    0    0    0    0    0    0   69    0   69    0
END
