COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.916  -0.349   0.093  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.156  -0.483   1.179  1.00  0.00           C  
HETATM    3  C   UNL     1      -7.043   0.667   0.253  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.946   0.654   0.246  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.619   0.352   0.199  1.00  0.00           C  
HETATM    6  C   UNL     1       3.938   0.503   1.495  1.00  0.00           C  
HETATM    7  C   UNL     1       8.290   1.090  -0.733  1.00  0.00           C  
HETATM    8  O   UNL     1       6.643   0.683   1.306  1.00  0.00           O  
HETATM    9  C   UNL     1       6.036   0.810   0.263  1.00  0.00           C  
HETATM   10  N   UNL     1       4.690   0.737   0.253  1.00  0.00           N  
HETATM   11  C   UNL     1       3.936   0.887  -1.000  1.00  0.00           C  
HETATM   12  C   UNL     1       2.968  -0.294  -1.131  1.00  0.00           C  
HETATM   13  N   UNL     1       2.146  -0.386   0.083  1.00  0.00           N  
HETATM   14  C   UNL     1       1.155  -1.335  -0.062  1.00  0.00           C  
HETATM   15  N   UNL     1       1.458  -2.611  -0.259  1.00  0.00           N  
HETATM   16  C   UNL     1       0.518  -3.531  -0.400  1.00  0.00           C  
HETATM   17  N   UNL     1      -0.763  -3.255  -0.355  1.00  0.00           N  
HETATM   18  C   UNL     1      -1.181  -1.995  -0.155  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.541  -1.668  -0.104  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.355   0.005   0.148  1.00  0.00           C  
HETATM   21  C   UNL     1      -6.495  -0.150   1.226  1.00  0.00           C  
HETATM   22  C   UNL     1      -6.255   1.154  -0.773  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.912   0.828  -0.831  1.00  0.00           C  
HETATM   24  F   UNL     1      -4.142   1.305  -1.834  1.00  0.00           F  
HETATM   25  C   UNL     1      -0.212  -0.972  -0.005  1.00  0.00           C  
HETATM   26 CL   UNL     1      -2.445   2.297   0.499  1.00  0.00          Cl  
HETATM   27  C   UNL     1       2.971  -0.663   1.266  1.00  0.00           C  
HETATM   28  C   UNL     1       6.787   1.050  -1.021  1.00  0.00           C  
HETATM   29  H   UNL     1      -4.732  -1.123   1.938  1.00  0.00           H  
HETATM   30  H   UNL     1      -8.091   0.924   0.294  1.00  0.00           H  
HETATM   31  H   UNL     1       0.118   1.133   0.317  1.00  0.00           H  
HETATM   32  H   UNL     1       4.629   0.253   2.300  1.00  0.00           H  
HETATM   33  H   UNL     1       3.375   1.398   1.760  1.00  0.00           H  
HETATM   34  H   UNL     1       8.504   1.896  -0.031  1.00  0.00           H  
HETATM   35  H   UNL     1       8.602   0.139  -0.302  1.00  0.00           H  
HETATM   36  H   UNL     1       8.833   1.264  -1.662  1.00  0.00           H  
HETATM   37  H   UNL     1       3.373   1.820  -0.979  1.00  0.00           H  
HETATM   38  H   UNL     1       4.625   0.891  -1.844  1.00  0.00           H  
HETATM   39  H   UNL     1       2.324  -0.143  -1.997  1.00  0.00           H  
HETATM   40  H   UNL     1       3.536  -1.217  -1.256  1.00  0.00           H  
HETATM   41  H   UNL     1       0.819  -4.556  -0.558  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.291  -2.437  -0.217  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.116  -0.527   2.025  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.688   1.791  -1.530  1.00  0.00           H  
HETATM   45  H   UNL     1       3.538  -1.580   1.107  1.00  0.00           H  
HETATM   46  H   UNL     1       2.328  -0.779   2.139  1.00  0.00           H  
HETATM   47  H   UNL     1       6.475   2.001  -1.452  1.00  0.00           H  
HETATM   48  H   UNL     1       6.573   0.245  -1.723  1.00  0.00           H  
CONECT    1    4    4   19   20                                       
CONECT    2   21   21   20   29                                       
CONECT    3   21   22   22   30                                       
CONECT    4    5   26    1    1                                       
CONECT    5   25   25    4   31                                       
CONECT    6   10   27   32   33                                       
CONECT    7   28   34   35   36                                       
CONECT    8    9    9                                                 
CONECT    9   28   10    8    8                                       
CONECT   10   11    9    6                                            
CONECT   11   12   10   37   38                                       
CONECT   12   11   13   39   40                                       
CONECT   13   12   14   27                                            
CONECT   14   13   15   15   25                                       
CONECT   15   14   14   16                                            
CONECT   16   15   17   17   41                                       
CONECT   17   16   16   18                                            
CONECT   18   25   17   19   19                                       
CONECT   19   18   18    1   42                                       
CONECT   20    2    1   23   23                                       
CONECT   21    2    2    3   43                                       
CONECT   22    3    3   23   44                                       
CONECT   23   20   20   22   24                                       
CONECT   24   23                                                      
CONECT   25   14    5    5   18                                       
CONECT   26    4                                                      
CONECT   27   13    6   45   46                                       
CONECT   28    7    9   47   48                                       
CONECT   29    2                                                      
CONECT   30    3                                                      
CONECT   31    5                                                      
CONECT   32    6                                                      
CONECT   33    6                                                      
CONECT   34    7                                                      
CONECT   35    7                                                      
CONECT   36    7                                                      
CONECT   37   11                                                      
CONECT   38   11                                                      
CONECT   39   12                                                      
CONECT   40   12                                                      
CONECT   41   16                                                      
CONECT   42   19                                                      
CONECT   43   21                                                      
CONECT   44   22                                                      
CONECT   45   27                                                      
CONECT   46   27                                                      
CONECT   47   28                                                      
CONECT   48   28                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
