COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.472  -1.921  -1.010  1.00  0.00           C  
HETATM    2  C   UNL     1       3.667  -0.947  -0.452  1.00  0.00           C  
HETATM    3  C   UNL     1       4.569   0.088   0.078  1.00  0.00           C  
HETATM    4  C   UNL     1       8.277   2.392   0.177  1.00  0.00           C  
HETATM    5  C   UNL     1       9.319   1.722   0.795  1.00  0.00           C  
HETATM    6  C   UNL     1       9.203   0.373   1.085  1.00  0.00           C  
HETATM    7  C   UNL     1       8.045  -0.307   0.760  1.00  0.00           C  
HETATM    8  C   UNL     1       2.200  -0.945  -0.399  1.00  0.00           C  
HETATM    9  C   UNL     1       0.148   0.123   0.163  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.545   0.659   1.239  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.926   0.705   1.218  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.620   0.216   0.122  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.927  -0.321  -0.956  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.990  -2.002   0.869  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.721  -3.102   1.282  1.00  0.00           C  
HETATM   16  C   UNL     1      -6.730  -1.990   1.017  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.058  -0.834   0.588  1.00  0.00           C  
HETATM   18  C   UNL     1      -8.287  -0.428   0.574  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.782   3.675   0.018  1.00  0.00           C  
HETATM   20  C   UNL     1      -7.603   2.029  -1.271  1.00  0.00           C  
HETATM   21  F   UNL     1      -2.603  -0.797  -2.024  1.00  0.00           F  
HETATM   22  O   UNL     1      -3.979   0.262   0.102  1.00  0.00           O  
HETATM   23  C   UNL     1      -4.660  -0.837   0.512  1.00  0.00           C  
HETATM   24  C   UNL     1      -7.098   0.166   0.307  1.00  0.00           C  
HETATM   25  C   UNL     1      -6.888   1.553  -0.173  1.00  0.00           C  
HETATM   26  C   UNL     1      -7.403   3.320  -1.715  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.495   4.142  -1.072  1.00  0.00           C  
HETATM   28  C   UNL     1      -5.974   2.385   0.471  1.00  0.00           C  
HETATM   29  N   UNL     1      -8.076  -1.710   0.997  1.00  0.00           N  
HETATM   30  N   UNL     1      -6.036  -3.074   1.345  1.00  0.00           N  
HETATM   31  C   UNL     1      -0.546  -0.367  -0.936  1.00  0.00           C  
HETATM   32  N   UNL     1       1.548   0.081   0.182  1.00  0.00           N  
HETATM   33  O   UNL     1       1.572  -1.870  -0.880  1.00  0.00           O  
HETATM   34  O   UNL     1       4.245   1.113   0.647  1.00  0.00           O  
HETATM   35  N   UNL     1       5.825  -0.324  -0.191  1.00  0.00           N  
HETATM   36  N   UNL     1       5.758  -1.552  -0.856  1.00  0.00           N  
HETATM   37  C   UNL     1       6.916  -2.323  -1.316  1.00  0.00           C  
HETATM   38  C   UNL     1       3.993  -3.186  -1.674  1.00  0.00           C  
HETATM   39  C   UNL     1       6.999   0.363   0.140  1.00  0.00           C  
HETATM   40  F   UNL     1      10.453   2.385   1.114  1.00  0.00           F  
HETATM   41  C   UNL     1       7.118   1.716  -0.151  1.00  0.00           C  
HETATM   42  H   UNL     1       8.368   3.445  -0.045  1.00  0.00           H  
HETATM   43  H   UNL     1      10.017  -0.148   1.567  1.00  0.00           H  
HETATM   44  H   UNL     1       7.955  -1.359   0.986  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.005   1.039   2.094  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.464   1.122   2.056  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.912  -2.046   0.829  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.199  -4.007   1.560  1.00  0.00           H  
HETATM   49  H   UNL     1      -9.254   0.041   0.469  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.071   4.320   0.514  1.00  0.00           H  
HETATM   51  H   UNL     1      -8.312   1.388  -1.774  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.957   3.690  -2.565  1.00  0.00           H  
HETATM   53  H   UNL     1      -6.342   5.152  -1.422  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.417   2.022   1.321  1.00  0.00           H  
HETATM   55  H   UNL     1      -8.776  -2.334   1.246  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.007  -0.784  -1.774  1.00  0.00           H  
HETATM   57  H   UNL     1       2.049   0.791   0.613  1.00  0.00           H  
HETATM   58  H   UNL     1       7.238  -3.002  -0.526  1.00  0.00           H  
HETATM   59  H   UNL     1       6.640  -2.899  -2.200  1.00  0.00           H  
HETATM   60  H   UNL     1       7.730  -1.643  -1.565  1.00  0.00           H  
HETATM   61  H   UNL     1       2.904  -3.220  -1.648  1.00  0.00           H  
HETATM   62  H   UNL     1       4.333  -3.205  -2.709  1.00  0.00           H  
HETATM   63  H   UNL     1       4.395  -4.050  -1.144  1.00  0.00           H  
HETATM   64  H   UNL     1       6.303   2.240  -0.629  1.00  0.00           H  
CONECT    1   36   38    2    2                                       
CONECT    2    1    1    3    8                                       
CONECT    3   35    2   34   34                                       
CONECT    4    5   41   41   42                                       
CONECT    5   40    6    6    4                                       
CONECT    6    5    5    7   43                                       
CONECT    7    6   39   39   44                                       
CONECT    8    2   33   33   32                                       
CONECT    9   32   10   10   31                                       
CONECT   10    9    9   11   45                                       
CONECT   11   10   12   12   46                                       
CONECT   12   11   11   13   22                                       
CONECT   13   31   31   12   21                                       
CONECT   14   23   23   15   47                                       
CONECT   15   14   30   30   48                                       
CONECT   16   17   17   30   29                                       
CONECT   17   23   16   16   24                                       
CONECT   18   24   24   29   49                                       
CONECT   19   28   28   27   50                                       
CONECT   20   25   25   26   51                                       
CONECT   21   13                                                      
CONECT   22   12   23                                                 
CONECT   23   22   14   14   17                                       
CONECT   24   17   25   18   18                                       
CONECT   25   28   24   20   20                                       
CONECT   26   27   27   20   52                                       
CONECT   27   19   26   26   53                                       
CONECT   28   19   19   25   54                                       
CONECT   29   16   18   55                                            
CONECT   30   15   15   16                                            
CONECT   31    9   13   13   56                                       
CONECT   32    8    9   57                                            
CONECT   33    8    8                                                 
CONECT   34    3    3                                                 
CONECT   35   36   39    3                                            
CONECT   36   37   35    1                                            
CONECT   37   36   58   59   60                                       
CONECT   38    1   61   62   63                                       
CONECT   39    7    7   41   35                                       
CONECT   40    5                                                      
CONECT   41    4    4   39   64                                       
CONECT   42    4                                                      
CONECT   43    6                                                      
CONECT   44    7                                                      
CONECT   45   10                                                      
CONECT   46   11                                                      
CONECT   47   14                                                      
CONECT   48   15                                                      
CONECT   49   18                                                      
CONECT   50   19                                                      
CONECT   51   20                                                      
CONECT   52   26                                                      
CONECT   53   27                                                      
CONECT   54   28                                                      
CONECT   55   29                                                      
CONECT   56   31                                                      
CONECT   57   32                                                      
CONECT   58   37                                                      
CONECT   59   37                                                      
CONECT   60   37                                                      
CONECT   61   38                                                      
CONECT   62   38                                                      
CONECT   63   38                                                      
CONECT   64   41                                                      
MASTER        0    0    0    0    0    0    0    0   64    0   64    0
END
