COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.909  -2.100   0.542  1.00  0.00           C  
HETATM    2  O   UNL     1       4.505   1.568  -0.399  1.00  0.00           O  
HETATM    3  C   UNL     1       2.934  -2.620   1.615  1.00  0.00           C  
HETATM    4  C   UNL     1       3.007  -1.054  -0.228  1.00  0.00           C  
HETATM    5  C   UNL     1       2.259  -1.749   0.747  1.00  0.00           C  
HETATM    6  C   UNL     1       0.864  -1.551   0.848  1.00  0.00           C  
HETATM    7  C   UNL     1       0.253  -0.678  -0.013  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.207  -0.448   0.067  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.094  -1.413  -0.414  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.454  -1.198  -0.339  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.943  -0.017   0.218  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.405   0.214   0.299  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.938   0.903   1.390  1.00  0.00           C  
HETATM   14  N   UNL     1       6.273  -2.286   0.442  1.00  0.00           N  
HETATM   15  C   UNL     1       6.957  -3.201   1.360  1.00  0.00           C  
HETATM   16  O   UNL     1       0.524   0.805  -1.783  1.00  0.00           O  
HETATM   17  C   UNL     1      -7.307   1.111   1.450  1.00  0.00           C  
HETATM   18  C   UNL     1      -8.096   0.623   0.418  1.00  0.00           C  
HETATM   19  C   UNL     1      -7.501  -0.051  -0.632  1.00  0.00           C  
HETATM   20  C   UNL     1      -8.356  -0.581  -1.754  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.057   0.948   0.699  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.699   0.732   0.629  1.00  0.00           C  
HETATM   23  C   UNL     1       1.058   0.027  -1.013  1.00  0.00           C  
HETATM   24  C   UNL     1       3.173   0.506  -2.114  1.00  0.00           C  
HETATM   25  C   UNL     1       3.686   1.829  -1.541  1.00  0.00           C  
HETATM   26  C   UNL     1       5.013   2.750   0.229  1.00  0.00           C  
HETATM   27  C   UNL     1       3.836   3.637   0.647  1.00  0.00           C  
HETATM   28  C   UNL     1       2.953   3.898  -0.579  1.00  0.00           C  
HETATM   29  F   UNL     1      -5.131   1.360   2.372  1.00  0.00           F  
HETATM   30  N   UNL     1       4.239  -2.763   1.479  1.00  0.00           N  
HETATM   31  N   UNL     1       4.317  -1.264  -0.297  1.00  0.00           N  
HETATM   32  N   UNL     1      -6.196  -0.231  -0.669  1.00  0.00           N  
HETATM   33  N   UNL     1       2.385  -0.194  -1.097  1.00  0.00           N  
HETATM   34  N   UNL     1       4.342   4.912   1.172  1.00  0.00           N  
HETATM   35  O   UNL     1       2.576   2.643  -1.155  1.00  0.00           O  
HETATM   36 CL   UNL     1      -1.485  -2.884  -1.108  1.00  0.00          Cl  
HETATM   37  H   UNL     1       2.398  -3.162   2.380  1.00  0.00           H  
HETATM   38  H   UNL     1       0.287  -2.080   1.592  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.140  -1.944  -0.712  1.00  0.00           H  
HETATM   40  H   UNL     1       6.780  -1.811  -0.235  1.00  0.00           H  
HETATM   41  H   UNL     1       8.022  -3.217   1.131  1.00  0.00           H  
HETATM   42  H   UNL     1       6.811  -2.862   2.386  1.00  0.00           H  
HETATM   43  H   UNL     1       6.545  -4.204   1.247  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.749   1.640   2.281  1.00  0.00           H  
HETATM   45  H   UNL     1      -9.167   0.765   0.438  1.00  0.00           H  
HETATM   46  H   UNL     1      -8.450   0.178  -2.530  1.00  0.00           H  
HETATM   47  H   UNL     1      -7.892  -1.474  -2.173  1.00  0.00           H  
HETATM   48  H   UNL     1      -9.344  -0.832  -1.370  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.436   1.862   1.129  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.013   1.479   1.002  1.00  0.00           H  
HETATM   51  H   UNL     1       2.549   0.705  -2.985  1.00  0.00           H  
HETATM   52  H   UNL     1       4.020  -0.114  -2.408  1.00  0.00           H  
HETATM   53  H   UNL     1       4.273   2.350  -2.297  1.00  0.00           H  
HETATM   54  H   UNL     1       5.593   2.474   1.110  1.00  0.00           H  
HETATM   55  H   UNL     1       5.649   3.290  -0.472  1.00  0.00           H  
HETATM   56  H   UNL     1       3.252   3.131   1.416  1.00  0.00           H  
HETATM   57  H   UNL     1       2.059   4.443  -0.276  1.00  0.00           H  
HETATM   58  H   UNL     1       3.509   4.483  -1.311  1.00  0.00           H  
HETATM   59  H   UNL     1       3.583   5.514   1.454  1.00  0.00           H  
HETATM   60  H   UNL     1       4.985   4.759   1.934  1.00  0.00           H  
CONECT    1   31   31   30   14                                       
CONECT    2   25   26                                                 
CONECT    3    5   30   30   37                                       
CONECT    4   33    5    5   31                                       
CONECT    5    6    4    4    3                                       
CONECT    6    7    7    5   38                                       
CONECT    7    8   23    6    6                                       
CONECT    8    9    9   22    7                                       
CONECT    9   10   36    8    8                                       
CONECT   10   11   11    9   39                                       
CONECT   11   12   10   10   21                                       
CONECT   12   32   32   13   11                                       
CONECT   13   17   17   12   29                                       
CONECT   14    1   15   40                                            
CONECT   15   14   41   42   43                                       
CONECT   16   23   23                                                 
CONECT   17   18   13   13   44                                       
CONECT   18   19   19   17   45                                       
CONECT   19   20   18   18   32                                       
CONECT   20   19   46   47   48                                       
CONECT   21   11   22   22   49                                       
CONECT   22   21   21    8   50                                       
CONECT   23   16   16    7   33                                       
CONECT   24   25   33   51   52                                       
CONECT   25   35   24    2   53                                       
CONECT   26   27    2   54   55                                       
CONECT   27   28   34   26   56                                       
CONECT   28   35   27   57   58                                       
CONECT   29   13                                                      
CONECT   30    3    3    1                                            
CONECT   31    4    1    1                                            
CONECT   32   19   12   12                                            
CONECT   33   23   24    4                                            
CONECT   34   27   59   60                                            
CONECT   35   28   25                                                 
CONECT   36    9                                                      
CONECT   37    3                                                      
CONECT   38    6                                                      
CONECT   39   10                                                      
CONECT   40   14                                                      
CONECT   41   15                                                      
CONECT   42   15                                                      
CONECT   43   15                                                      
CONECT   44   17                                                      
CONECT   45   18                                                      
CONECT   46   20                                                      
CONECT   47   20                                                      
CONECT   48   20                                                      
CONECT   49   21                                                      
CONECT   50   22                                                      
CONECT   51   24                                                      
CONECT   52   24                                                      
CONECT   53   25                                                      
CONECT   54   26                                                      
CONECT   55   26                                                      
CONECT   56   27                                                      
CONECT   57   28                                                      
CONECT   58   28                                                      
CONECT   59   34                                                      
CONECT   60   34                                                      
MASTER        0    0    0    0    0    0    0    0   60    0   60    0
END
