COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.413  -1.025   3.222  1.00  0.00           C  
HETATM    2  C   UNL     1       2.868  -0.677   1.989  1.00  0.00           C  
HETATM    3  C   UNL     1       2.906   0.688   1.658  1.00  0.00           C  
HETATM    4  N   UNL     1       3.441   1.597   2.491  1.00  0.00           N  
HETATM    5  C   UNL     1       3.937   1.134   3.657  1.00  0.00           C  
HETATM    6  N   UNL     1       3.956  -0.140   4.080  1.00  0.00           N  
HETATM    7  C   UNL     1       2.307  -1.619   1.110  1.00  0.00           C  
HETATM    8  C   UNL     1       1.778  -1.205  -0.109  1.00  0.00           C  
HETATM    9  C   UNL     1       1.810   0.143  -0.448  1.00  0.00           C  
HETATM   10  C   UNL     1       2.370   1.074   0.432  1.00  0.00           C  
HETATM   11  N   UNL     1       4.496   2.095   4.527  1.00  0.00           N  
HETATM   12  C   UNL     1       1.199  -2.170  -1.017  1.00  0.00           C  
HETATM   13  C   UNL     1       2.017  -2.781  -1.970  1.00  0.00           C  
HETATM   14  C   UNL     1       1.482  -3.715  -2.857  1.00  0.00           C  
HETATM   15  C   UNL     1       0.127  -4.040  -2.793  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.692  -3.431  -1.843  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.157  -2.497  -0.956  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.067  -1.865   0.048  1.00  0.00           C  
HETATM   19  C   UNL     1       2.336  -4.350  -3.848  1.00  0.00           C  
HETATM   20  O   UNL     1       3.546  -4.526  -3.649  1.00  0.00           O  
HETATM   21  N   UNL     1       1.680  -4.776  -5.013  1.00  0.00           N  
HETATM   22  C   UNL     1       2.224  -5.453  -6.134  1.00  0.00           C  
HETATM   23  C   UNL     1       1.394  -5.786  -7.190  1.00  0.00           C  
HETATM   24  C   UNL     1       1.930  -6.450  -8.293  1.00  0.00           C  
HETATM   25  C   UNL     1       3.286  -6.772  -8.322  1.00  0.00           C  
HETATM   26  C   UNL     1       4.108  -6.429  -7.248  1.00  0.00           C  
HETATM   27  C   UNL     1       3.572  -5.764  -6.145  1.00  0.00           C  
HETATM   28  C   UNL     1       1.052  -6.819  -9.441  1.00  0.00           C  
HETATM   29  F   UNL     1       1.711  -7.466 -10.448  1.00  0.00           F  
HETATM   30  F   UNL     1       0.023  -7.649  -9.098  1.00  0.00           F  
HETATM   31  F   UNL     1       0.467  -5.733 -10.025  1.00  0.00           F  
HETATM   32  H   UNL     1       3.429  -2.055   3.564  1.00  0.00           H  
HETATM   33  H   UNL     1       2.287  -2.672   1.385  1.00  0.00           H  
HETATM   34  H   UNL     1       1.404   0.491  -1.395  1.00  0.00           H  
HETATM   35  H   UNL     1       2.383   2.124   0.143  1.00  0.00           H  
HETATM   36  H   UNL     1       4.393   1.976   5.514  1.00  0.00           H  
HETATM   37  H   UNL     1       4.902   2.922   4.141  1.00  0.00           H  
HETATM   38  H   UNL     1       3.075  -2.531  -2.024  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.300  -4.767  -3.479  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.747  -3.692  -1.802  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.625  -1.923   1.049  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.251  -0.812  -0.194  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.043  -2.365   0.066  1.00  0.00           H  
HETATM   44  H   UNL     1       0.684  -4.574  -5.059  1.00  0.00           H  
HETATM   45  H   UNL     1       0.336  -5.536  -7.169  1.00  0.00           H  
HETATM   46  H   UNL     1       3.713  -7.290  -9.177  1.00  0.00           H  
HETATM   47  H   UNL     1       5.164  -6.680  -7.270  1.00  0.00           H  
HETATM   48  H   UNL     1       4.222  -5.502  -5.314  1.00  0.00           H  
CONECT    1    6    6    2   32                                       
CONECT    2    1    7    7    3                                       
CONECT    3    2    4   10   10                                       
CONECT    4    3    5    5                                            
CONECT    5    4    4    6   11                                       
CONECT    6    1    1    5                                            
CONECT    7    2    2    8   33                                       
CONECT    8    7   12    9    9                                       
CONECT    9    8    8   10   34                                       
CONECT   10    3    3    9   35                                       
CONECT   11    5   36   37                                            
CONECT   12    8   17   13   13                                       
CONECT   13   12   12   14   38                                       
CONECT   14   13   15   15   19                                       
CONECT   15   14   14   16   39                                       
CONECT   16   15   17   17   40                                       
CONECT   17   12   16   16   18                                       
CONECT   18   17   41   42   43                                       
CONECT   19   14   21   20   20                                       
CONECT   20   19   19                                                 
CONECT   21   19   22   44                                            
CONECT   22   21   27   27   23                                       
CONECT   23   22   24   24   45                                       
CONECT   24   23   23   25   28                                       
CONECT   25   24   26   26   46                                       
CONECT   26   25   25   27   47                                       
CONECT   27   22   22   26   48                                       
CONECT   28   24   30   31   29                                       
CONECT   29   28                                                      
CONECT   30   28                                                      
CONECT   31   28                                                      
CONECT   32    1                                                      
CONECT   33    7                                                      
CONECT   34    9                                                      
CONECT   35   10                                                      
CONECT   36   11                                                      
CONECT   37   11                                                      
CONECT   38   13                                                      
CONECT   39   15                                                      
CONECT   40   16                                                      
CONECT   41   18                                                      
CONECT   42   18                                                      
CONECT   43   18                                                      
CONECT   44   21                                                      
CONECT   45   23                                                      
CONECT   46   25                                                      
CONECT   47   26                                                      
CONECT   48   27                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
