COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       0.591   0.838   0.623  1.00  0.00           N  
HETATM    2  C   UNL     1       2.673   2.994   1.192  1.00  0.00           C  
HETATM    3  N   UNL     1       2.631   0.103  -0.183  1.00  0.00           N  
HETATM    4  C   UNL     1       1.041  -1.464   0.503  1.00  0.00           C  
HETATM    5  C   UNL     1       2.288  -1.165  -0.010  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.810   0.602   1.602  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.070   0.158   0.318  1.00  0.00           C  
HETATM    8  C   UNL     1       0.182  -0.411   0.822  1.00  0.00           C  
HETATM    9  C   UNL     1       3.249  -2.269  -0.370  1.00  0.00           C  
HETATM   10  C   UNL     1       3.676   2.834  -2.044  1.00  0.00           C  
HETATM   11  C   UNL     1       3.577   2.460  -0.564  1.00  0.00           C  
HETATM   12  C   UNL     1       3.802   3.648   0.383  1.00  0.00           C  
HETATM   13  N   UNL     1       2.190   2.395  -0.066  1.00  0.00           N  
HETATM   14  C   UNL     1       1.795   1.083   0.130  1.00  0.00           C  
HETATM   15  N   UNL     1      -1.078  -0.664   1.339  1.00  0.00           N  
HETATM   16  C   UNL     1      -3.298   0.191   1.639  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.374  -1.111   0.815  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.926  -1.377   0.350  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.597   0.200   0.393  1.00  0.00           C  
HETATM   20  C   UNL     1      -6.167   0.287  -0.999  1.00  0.00           C  
HETATM   21  O   UNL     1      -5.426   0.312  -1.954  1.00  0.00           O  
HETATM   22  O   UNL     1      -7.496   0.336  -1.179  1.00  0.00           O  
HETATM   23  F   UNL     1       2.722  -3.019  -1.427  1.00  0.00           F  
HETATM   24  F   UNL     1       4.473  -1.714  -0.757  1.00  0.00           F  
HETATM   25  F   UNL     1       3.442  -3.099   0.740  1.00  0.00           F  
HETATM   26  H   UNL     1       3.026   2.259   1.916  1.00  0.00           H  
HETATM   27  H   UNL     1       1.977   3.712   1.627  1.00  0.00           H  
HETATM   28  H   UNL     1       0.737  -2.490   0.653  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.508   1.024   2.561  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.633   1.319   0.800  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.627   0.671  -0.535  1.00  0.00           H  
HETATM   32  H   UNL     1       3.225   3.814  -2.202  1.00  0.00           H  
HETATM   33  H   UNL     1       4.724   2.864  -2.342  1.00  0.00           H  
HETATM   34  H   UNL     1       3.149   2.091  -2.642  1.00  0.00           H  
HETATM   35  H   UNL     1       4.171   1.583  -0.310  1.00  0.00           H  
HETATM   36  H   UNL     1       3.541   4.616  -0.045  1.00  0.00           H  
HETATM   37  H   UNL     1       4.770   3.642   0.883  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.839   0.336   2.574  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.975  -1.961   1.139  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.768  -0.972  -0.649  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.712  -2.446   0.366  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.963  -0.704   0.879  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.909   1.073   0.968  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.814   0.391  -2.091  1.00  0.00           H  
CONECT    1   14   14    8                                            
CONECT    2   12   13   26   27                                       
CONECT    3   14    5    5                                            
CONECT    4    8    8    5   28                                       
CONECT    5    3    3    9    4                                       
CONECT    6   15   16   29   30                                       
CONECT    7   17   16   19   31                                       
CONECT    8    1   15    4    4                                       
CONECT    9   23    5   24   25                                       
CONECT   10   11   32   33   34                                       
CONECT   11   12   10   13   35                                       
CONECT   12    2   11   36   37                                       
CONECT   13    2   11   14                                            
CONECT   14   13    1    1    3                                       
CONECT   15   18    8    6                                            
CONECT   16   17    6    7   38                                       
CONECT   17   18   16    7   39                                       
CONECT   18   15   17   40   41                                       
CONECT   19    7   20   42   43                                       
CONECT   20   21   21   19   22                                       
CONECT   21   20   20                                                 
CONECT   22   20   44                                                 
CONECT   23    9                                                      
CONECT   24    9                                                      
CONECT   25    9                                                      
CONECT   26    2                                                      
CONECT   27    2                                                      
CONECT   28    4                                                      
CONECT   29    6                                                      
CONECT   30    6                                                      
CONECT   31    7                                                      
CONECT   32   10                                                      
CONECT   33   10                                                      
CONECT   34   10                                                      
CONECT   35   11                                                      
CONECT   36   12                                                      
CONECT   37   12                                                      
CONECT   38   16                                                      
CONECT   39   17                                                      
CONECT   40   18                                                      
CONECT   41   18                                                      
CONECT   42   19                                                      
CONECT   43   19                                                      
CONECT   44   22                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
