COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -3.162   2.257  -0.846  1.00  0.00           O  
HETATM    2  C   UNL     1      -4.064   1.734  -0.227  1.00  0.00           C  
HETATM    3  N   UNL     1      -5.283   2.309  -0.197  1.00  0.00           N  
HETATM    4  O   UNL     1      -6.336   1.699   0.525  1.00  0.00           O  
HETATM    5  C   UNL     1      -5.517   3.566  -0.913  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.825   0.438   0.504  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.402  -0.050   0.224  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.213  -1.443   0.827  1.00  0.00           C  
HETATM    9  P   UNL     1      -3.055  -2.677  -0.218  1.00  0.00           P  
HETATM   10  O   UNL     1      -2.778  -4.152   0.365  1.00  0.00           O  
HETATM   11  O   UNL     1      -4.639  -2.389  -0.218  1.00  0.00           O  
HETATM   12  O   UNL     1      -2.536  -2.588  -1.601  1.00  0.00           O  
HETATM   13  C   UNL     1      -1.397   0.918   0.852  1.00  0.00           C  
HETATM   14  C   UNL     1       0.023   0.500   0.467  1.00  0.00           C  
HETATM   15  C   UNL     1       1.028   1.469   1.095  1.00  0.00           C  
HETATM   16  C   UNL     1       2.427   1.057   0.716  1.00  0.00           C  
HETATM   17  C   UNL     1       3.009   1.561  -0.432  1.00  0.00           C  
HETATM   18  C   UNL     1       4.292   1.183  -0.780  1.00  0.00           C  
HETATM   19  C   UNL     1       3.130   0.179   1.519  1.00  0.00           C  
HETATM   20  C   UNL     1       4.416  -0.194   1.175  1.00  0.00           C  
HETATM   21  C   UNL     1       4.993   0.300   0.020  1.00  0.00           C  
HETATM   22  C   UNL     1       6.395  -0.107  -0.355  1.00  0.00           C  
HETATM   23  F   UNL     1       7.006   0.930  -1.070  1.00  0.00           F  
HETATM   24  F   UNL     1       7.131  -0.370   0.805  1.00  0.00           F  
HETATM   25  F   UNL     1       6.350  -1.257  -1.150  1.00  0.00           F  
HETATM   26  H   UNL     1      -7.172   2.184   0.488  1.00  0.00           H  
HETATM   27  H   UNL     1      -5.845   3.349  -1.930  1.00  0.00           H  
HETATM   28  H   UNL     1      -6.287   4.139  -0.397  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.594   4.144  -0.944  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.950   0.597   1.575  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.540  -0.310   0.162  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.239  -0.095  -0.853  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.149  -1.676   0.879  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.638  -1.466   1.831  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.197  -4.861  -0.142  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.046  -2.431   0.658  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.590   1.928   0.488  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.501   0.897   1.937  1.00  0.00           H  
HETATM   39  H   UNL     1       0.216  -0.509   0.831  1.00  0.00           H  
HETATM   40  H   UNL     1       0.127   0.522  -0.618  1.00  0.00           H  
HETATM   41  H   UNL     1       0.835   2.478   0.732  1.00  0.00           H  
HETATM   42  H   UNL     1       0.924   1.447   2.180  1.00  0.00           H  
HETATM   43  H   UNL     1       2.461   2.250  -1.057  1.00  0.00           H  
HETATM   44  H   UNL     1       4.747   1.577  -1.677  1.00  0.00           H  
HETATM   45  H   UNL     1       2.675  -0.216   2.416  1.00  0.00           H  
HETATM   46  H   UNL     1       4.964  -0.884   1.800  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    3    1    1    6                                       
CONECT    3    5    4    2                                            
CONECT    4    3   26                                                 
CONECT    5    3   27   28   29                                       
CONECT    6    2    7   30   31                                       
CONECT    7   13    6    8   32                                       
CONECT    8    7    9   33   34                                       
CONECT    9   12   12    8   11                                       
CONECT    9   10                                                      
CONECT   10    9   35                                                 
CONECT   11    9   36                                                 
CONECT   12    9    9                                                 
CONECT   13   14    7   37   38                                       
CONECT   14   15   13   39   40                                       
CONECT   15   16   14   41   42                                       
CONECT   16   19   19   17   15                                       
CONECT   17   18   18   16   43                                       
CONECT   18   21   17   17   44                                       
CONECT   19   20   16   16   45                                       
CONECT   20   21   21   19   46                                       
CONECT   21   22   20   20   18                                       
CONECT   22   24   23   25   21                                       
CONECT   23   22                                                      
CONECT   24   22                                                      
CONECT   25   22                                                      
CONECT   26    4                                                      
CONECT   27    5                                                      
CONECT   28    5                                                      
CONECT   29    5                                                      
CONECT   30    6                                                      
CONECT   31    6                                                      
CONECT   32    7                                                      
CONECT   33    8                                                      
CONECT   34    8                                                      
CONECT   35   10                                                      
CONECT   36   11                                                      
CONECT   37   13                                                      
CONECT   38   13                                                      
CONECT   39   14                                                      
CONECT   40   14                                                      
CONECT   41   15                                                      
CONECT   42   15                                                      
CONECT   43   17                                                      
CONECT   44   18                                                      
CONECT   45   19                                                      
CONECT   46   20                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
