COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.485   0.702  -2.162  1.00  0.00           C  
HETATM    2  C   UNL     1       3.328   1.693  -0.187  1.00  0.00           C  
HETATM    3  C   UNL     1       4.247   2.627   0.260  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.464  -0.401  -2.080  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.116   0.074  -0.161  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.609   0.043   0.111  1.00  0.00           C  
HETATM    7  C   UNL     1      -7.031   0.010   0.368  1.00  0.00           C  
HETATM    8  C   UNL     1      -7.090   1.420   0.960  1.00  0.00           C  
HETATM    9  C   UNL     1      -7.000  -1.018   1.501  1.00  0.00           C  
HETATM   10  C   UNL     1      -8.266  -0.229  -0.504  1.00  0.00           C  
HETATM   11  C   UNL     1       2.249  -1.114  -0.056  1.00  0.00           C  
HETATM   12  C   UNL     1       2.036  -2.345   0.568  1.00  0.00           C  
HETATM   13  C   UNL     1       3.110  -3.152   0.888  1.00  0.00           C  
HETATM   14  C   UNL     1       4.401  -2.749   0.593  1.00  0.00           C  
HETATM   15  C   UNL     1       4.627  -1.527  -0.014  1.00  0.00           C  
HETATM   16  C   UNL     1       3.560  -0.702  -0.328  1.00  0.00           C  
HETATM   17 CL   UNL     1       2.839  -4.681   1.665  1.00  0.00          Cl  
HETATM   18  N   UNL     1       3.786   0.561  -0.882  1.00  0.00           N  
HETATM   19  C   UNL     1       3.468   0.670  -3.305  1.00  0.00           C  
HETATM   20  C   UNL     1       1.103  -0.284  -0.453  1.00  0.00           C  
HETATM   21  N   UNL     1       1.030   0.998  -0.386  1.00  0.00           N  
HETATM   22  C   UNL     1       1.969   1.865   0.087  1.00  0.00           C  
HETATM   23  C   UNL     1       1.558   2.960   0.851  1.00  0.00           C  
HETATM   24  C   UNL     1       2.487   3.881   1.301  1.00  0.00           C  
HETATM   25  F   UNL     1       2.084   4.939   2.038  1.00  0.00           F  
HETATM   26  C   UNL     1       3.827   3.721   0.998  1.00  0.00           C  
HETATM   27  N   UNL     1       0.000  -0.944  -0.945  1.00  0.00           N  
HETATM   28  C   UNL     1      -1.181  -0.185  -1.362  1.00  0.00           C  
HETATM   29  N   UNL     1      -3.497  -0.083  -0.641  1.00  0.00           N  
HETATM   30  C   UNL     1      -2.068  -1.029  -2.316  1.00  0.00           C  
HETATM   31  O   UNL     1      -4.516   0.308   1.293  1.00  0.00           O  
HETATM   32  N   UNL     1      -5.823  -0.127  -0.449  1.00  0.00           N  
HETATM   33  H   UNL     1       5.022   1.650  -2.180  1.00  0.00           H  
HETATM   34  H   UNL     1       5.192  -0.119  -2.282  1.00  0.00           H  
HETATM   35  H   UNL     1       5.296   2.502   0.033  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.248  -1.116  -2.329  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.576   0.507  -2.672  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.913  -0.648   0.629  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.965   1.087   0.214  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.210   1.590   1.581  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.112   2.152   0.153  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.989   1.522   1.567  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.899  -0.916   2.109  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.958  -2.022   1.079  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.121  -0.847   2.122  1.00  0.00           H  
HETATM   46  H   UNL     1      -8.288   0.503  -1.311  1.00  0.00           H  
HETATM   47  H   UNL     1      -8.224  -1.233  -0.925  1.00  0.00           H  
HETATM   48  H   UNL     1      -9.165  -0.127   0.104  1.00  0.00           H  
HETATM   49  H   UNL     1       1.031  -2.666   0.802  1.00  0.00           H  
HETATM   50  H   UNL     1       5.235  -3.391   0.837  1.00  0.00           H  
HETATM   51  H   UNL     1       5.636  -1.216  -0.242  1.00  0.00           H  
HETATM   52  H   UNL     1       2.761   1.491  -3.185  1.00  0.00           H  
HETATM   53  H   UNL     1       3.988   0.775  -4.257  1.00  0.00           H  
HETATM   54  H   UNL     1       2.931  -0.278  -3.287  1.00  0.00           H  
HETATM   55  H   UNL     1       0.512   3.088   1.090  1.00  0.00           H  
HETATM   56  H   UNL     1       4.547   4.451   1.337  1.00  0.00           H  
HETATM   57  H   UNL     1       0.005  -1.911  -1.015  1.00  0.00           H  
HETATM   58  H   UNL     1      -0.889   0.754  -1.832  1.00  0.00           H  
HETATM   59  H   UNL     1      -2.058  -2.080  -2.030  1.00  0.00           H  
HETATM   60  H   UNL     1      -1.753  -0.905  -3.352  1.00  0.00           H  
HETATM   61  H   UNL     1      -5.897  -0.339  -1.393  1.00  0.00           H  
CONECT    1   18   19   33   34                                       
CONECT    2   22   18    3    3                                       
CONECT    3    2    2   26   35                                       
CONECT    4   30   29   36   37                                       
CONECT    5   29   28   38   39                                       
CONECT    6   32   29   31   31                                       
CONECT    7    9   32   10    8                                       
CONECT    8    7   40   41   42                                       
CONECT    9    7   43   44   45                                       
CONECT   10    7   46   47   48                                       
CONECT   11   12   20   16   16                                       
CONECT   12   13   13   11   49                                       
CONECT   13   17   12   12   14                                       
CONECT   14   13   15   15   50                                       
CONECT   15   14   14   16   51                                       
CONECT   16   11   11   15   18                                       
CONECT   17   13                                                      
CONECT   18   16    2    1                                            
CONECT   19    1   52   53   54                                       
CONECT   20   27   21   21   11                                       
CONECT   21   20   20   22                                            
CONECT   22   21   23   23    2                                       
CONECT   23   22   22   24   55                                       
CONECT   24   23   25   26   26                                       
CONECT   25   24                                                      
CONECT   26   24   24    3   56                                       
CONECT   27   28   20   57                                            
CONECT   28   30    5   27   58                                       
CONECT   29    4    6    5                                            
CONECT   30    4   28   59   60                                       
CONECT   31    6    6                                                 
CONECT   32    7    6   61                                            
CONECT   33    1                                                      
CONECT   34    1                                                      
CONECT   35    3                                                      
CONECT   36    4                                                      
CONECT   37    4                                                      
CONECT   38    5                                                      
CONECT   39    5                                                      
CONECT   40    8                                                      
CONECT   41    8                                                      
CONECT   42    8                                                      
CONECT   43    9                                                      
CONECT   44    9                                                      
CONECT   45    9                                                      
CONECT   46   10                                                      
CONECT   47   10                                                      
CONECT   48   10                                                      
CONECT   49   12                                                      
CONECT   50   14                                                      
CONECT   51   15                                                      
CONECT   52   19                                                      
CONECT   53   19                                                      
CONECT   54   19                                                      
CONECT   55   23                                                      
CONECT   56   26                                                      
CONECT   57   27                                                      
CONECT   58   28                                                      
CONECT   59   30                                                      
CONECT   60   30                                                      
CONECT   61   32                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
