COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.530  -2.151   0.927  1.00  0.00           C  
HETATM    2  C   UNL     1       5.468  -1.536   1.972  1.00  0.00           C  
HETATM    3  N   UNL     1       4.702  -1.213   3.183  1.00  0.00           N  
HETATM    4  C   UNL     1       3.675  -0.199   2.909  1.00  0.00           C  
HETATM    5  C   UNL     1       2.664  -0.760   1.903  1.00  0.00           C  
HETATM    6  N   UNL     1       3.397  -1.237   0.721  1.00  0.00           N  
HETATM    7  C   UNL     1       3.039  -0.848  -0.519  1.00  0.00           C  
HETATM    8  O   UNL     1       3.656  -1.253  -1.485  1.00  0.00           O  
HETATM    9  C   UNL     1       1.898   0.070  -0.703  1.00  0.00           C  
HETATM   10  C   UNL     1       0.596  -0.417  -0.875  1.00  0.00           C  
HETATM   11  C   UNL     1       0.337  -1.875  -0.873  1.00  0.00           C  
HETATM   12  C   UNL     1       0.558  -2.625   0.282  1.00  0.00           C  
HETATM   13  C   UNL     1       0.314  -3.983   0.277  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.149  -4.601  -0.871  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.370  -3.863  -2.020  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.136  -2.503  -2.026  1.00  0.00           C  
HETATM   17  C   UNL     1       2.082   1.476  -0.708  1.00  0.00           C  
HETATM   18  C   UNL     1       3.350   2.044  -0.538  1.00  0.00           C  
HETATM   19  C   UNL     1       3.489   3.402  -0.548  1.00  0.00           C  
HETATM   20  F   UNL     1       4.714   3.949  -0.384  1.00  0.00           F  
HETATM   21  C   UNL     1       2.382   4.231  -0.726  1.00  0.00           C  
HETATM   22  C   UNL     1       1.135   3.711  -0.893  1.00  0.00           C  
HETATM   23  C   UNL     1       0.954   2.316  -0.889  1.00  0.00           C  
HETATM   24  N   UNL     1      -0.262   1.784  -1.053  1.00  0.00           N  
HETATM   25  C   UNL     1      -0.461   0.492  -1.047  1.00  0.00           C  
HETATM   26  C   UNL     1      -1.860  -0.036  -1.232  1.00  0.00           C  
HETATM   27  C   UNL     1      -2.267   0.100  -2.700  1.00  0.00           C  
HETATM   28  N   UNL     1      -2.786   0.732  -0.396  1.00  0.00           N  
HETATM   29  C   UNL     1      -3.974   0.166   0.019  1.00  0.00           C  
HETATM   30  N   UNL     1      -4.291  -1.077  -0.335  1.00  0.00           N  
HETATM   31  C   UNL     1      -5.423  -1.628   0.056  1.00  0.00           C  
HETATM   32  N   UNL     1      -6.295  -0.988   0.808  1.00  0.00           N  
HETATM   33  C   UNL     1      -6.069   0.259   1.213  1.00  0.00           C  
HETATM   34  N   UNL     1      -6.989   0.920   2.001  1.00  0.00           N  
HETATM   35  C   UNL     1      -4.871   0.890   0.828  1.00  0.00           C  
HETATM   36  C   UNL     1      -4.576   2.229   1.241  1.00  0.00           C  
HETATM   37  N   UNL     1      -4.341   3.291   1.569  1.00  0.00           N  
HETATM   38  H   UNL     1       5.067  -2.287  -0.012  1.00  0.00           H  
HETATM   39  H   UNL     1       4.164  -3.114   1.285  1.00  0.00           H  
HETATM   40  H   UNL     1       6.255  -2.249   2.218  1.00  0.00           H  
HETATM   41  H   UNL     1       5.913  -0.626   1.569  1.00  0.00           H  
HETATM   42  H   UNL     1       4.292  -2.044   3.584  1.00  0.00           H  
HETATM   43  H   UNL     1       3.161   0.058   3.836  1.00  0.00           H  
HETATM   44  H   UNL     1       4.145   0.692   2.494  1.00  0.00           H  
HETATM   45  H   UNL     1       2.118  -1.588   2.355  1.00  0.00           H  
HETATM   46  H   UNL     1       1.964   0.024   1.612  1.00  0.00           H  
HETATM   47  H   UNL     1       0.919  -2.143   1.179  1.00  0.00           H  
HETATM   48  H   UNL     1       0.485  -4.564   1.171  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.338  -5.664  -0.870  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.732  -4.351  -2.913  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.313  -1.928  -2.922  1.00  0.00           H  
HETATM   52  H   UNL     1       4.214   1.410  -0.399  1.00  0.00           H  
HETATM   53  H   UNL     1       2.515   5.303  -0.730  1.00  0.00           H  
HETATM   54  H   UNL     1       0.288   4.366  -1.029  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.894  -1.086  -0.941  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.279  -0.282  -2.834  1.00  0.00           H  
HETATM   57  H   UNL     1      -2.233   1.150  -2.991  1.00  0.00           H  
HETATM   58  H   UNL     1      -1.578  -0.471  -3.323  1.00  0.00           H  
HETATM   59  H   UNL     1      -2.564   1.639  -0.133  1.00  0.00           H  
HETATM   60  H   UNL     1      -5.643  -2.639  -0.252  1.00  0.00           H  
HETATM   61  H   UNL     1      -7.810   0.475   2.265  1.00  0.00           H  
HETATM   62  H   UNL     1      -6.815   1.829   2.292  1.00  0.00           H  
CONECT    1    6    2   38   39                                       
CONECT    2    1    3   40   41                                       
CONECT    3    2    4   42                                            
CONECT    4    5    3   43   44                                       
CONECT    5    6    4   45   46                                       
CONECT    6    1    7    5                                            
CONECT    7    8    8    6    9                                       
CONECT    8    7    7                                                 
CONECT    9   17    7   10   10                                       
CONECT   10    9    9   25   11                                       
CONECT   11   10   12   12   16                                       
CONECT   12   11   11   13   47                                       
CONECT   13   12   14   14   48                                       
CONECT   14   13   13   15   49                                       
CONECT   15   16   16   14   50                                       
CONECT   16   11   15   15   51                                       
CONECT   17   18   18   23    9                                       
CONECT   18   19   17   17   52                                       
CONECT   19   20   21   21   18                                       
CONECT   20   19                                                      
CONECT   21   19   19   22   53                                       
CONECT   22   21   23   23   54                                       
CONECT   23   22   22   17   24                                       
CONECT   24   23   25   25                                            
CONECT   25   24   24   10   26                                       
CONECT   26   25   27   28   55                                       
CONECT   27   26   56   57   58                                       
CONECT   28   26   29   59                                            
CONECT   29   28   30   30   35                                       
CONECT   30   29   29   31                                            
CONECT   31   30   32   32   60                                       
CONECT   32   31   31   33                                            
CONECT   33   35   35   32   34                                       
CONECT   34   33   61   62                                            
CONECT   35   29   36   33   33                                       
CONECT   36   37   37   37   35                                       
CONECT   37   36   36   36                                            
CONECT   38    1                                                      
CONECT   39    1                                                      
CONECT   40    2                                                      
CONECT   41    2                                                      
CONECT   42    3                                                      
CONECT   43    4                                                      
CONECT   44    4                                                      
CONECT   45    5                                                      
CONECT   46    5                                                      
CONECT   47   12                                                      
CONECT   48   13                                                      
CONECT   49   14                                                      
CONECT   50   15                                                      
CONECT   51   16                                                      
CONECT   52   18                                                      
CONECT   53   21                                                      
CONECT   54   22                                                      
CONECT   55   26                                                      
CONECT   56   27                                                      
CONECT   57   27                                                      
CONECT   58   27                                                      
CONECT   59   28                                                      
CONECT   60   31                                                      
CONECT   61   34                                                      
CONECT   62   34                                                      
MASTER        0    0    0    0    0    0    0    0   62    0   62    0
END
