COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       2.514   0.189  -0.076  1.00  0.00           N  
HETATM    2  N   UNL     1      -2.987   2.699  -2.032  1.00  0.00           N  
HETATM    3  C   UNL     1       3.328   1.363  -0.401  1.00  0.00           C  
HETATM    4  C   UNL     1       1.850   0.115   1.222  1.00  0.00           C  
HETATM    5  C   UNL     1       0.466  -0.518   1.095  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.447   0.420   0.348  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.617   1.032  -0.403  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.241   2.862  -1.681  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.600   1.477   0.792  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.481   0.385   1.070  1.00  0.00           C  
HETATM   11  C   UNL     1       0.565  -1.821   0.345  1.00  0.00           C  
HETATM   12  C   UNL     1       0.783  -4.200  -1.064  1.00  0.00           C  
HETATM   13  C   UNL     1       1.617  -3.146  -1.380  1.00  0.00           C  
HETATM   14  C   UNL     1       1.511  -1.950  -0.675  1.00  0.00           C  
HETATM   15  O   UNL     1       2.983  -0.746  -2.041  1.00  0.00           O  
HETATM   16  C   UNL     1       2.388  -0.801  -0.983  1.00  0.00           C  
HETATM   17  C   UNL     1       4.722   1.173   0.137  1.00  0.00           C  
HETATM   18  O   UNL     1       5.035   0.121   0.654  1.00  0.00           O  
HETATM   19  N   UNL     1       5.622   2.172   0.046  1.00  0.00           N  
HETATM   20  C   UNL     1       6.978   1.987   0.569  1.00  0.00           C  
HETATM   21  C   UNL     1       7.940   2.924  -0.163  1.00  0.00           C  
HETATM   22  C   UNL     1       6.995   2.306   2.066  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.154  -4.067  -0.052  1.00  0.00           C  
HETATM   24 CL   UNL     1      -1.197  -5.399   0.338  1.00  0.00          Cl  
HETATM   25  C   UNL     1      -0.262  -2.878   0.652  1.00  0.00           C  
HETATM   26  O   UNL     1      -0.005   1.445  -0.127  1.00  0.00           O  
HETATM   27  N   UNL     1      -1.753   0.121   0.209  1.00  0.00           N  
HETATM   28  C   UNL     1      -3.957   1.157   0.025  1.00  0.00           C  
HETATM   29  C   UNL     1      -5.782   0.550   1.440  1.00  0.00           C  
HETATM   30  F   UNL     1      -7.886   1.616   1.184  1.00  0.00           F  
HETATM   31  C   UNL     1      -6.122   2.243  -0.229  1.00  0.00           C  
HETATM   32  C   UNL     1      -4.786   2.099  -0.636  1.00  0.00           C  
HETATM   33  C   UNL     1      -2.181   1.830  -1.440  1.00  0.00           C  
HETATM   34  H   UNL     1       3.370   1.487  -1.484  1.00  0.00           H  
HETATM   35  H   UNL     1       2.882   2.250   0.049  1.00  0.00           H  
HETATM   36  H   UNL     1       2.456  -0.485   1.901  1.00  0.00           H  
HETATM   37  H   UNL     1       1.747   1.120   1.630  1.00  0.00           H  
HETATM   38  H   UNL     1       0.059  -0.702   2.089  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.855   3.586  -2.197  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.858  -0.336   1.579  1.00  0.00           H  
HETATM   41  H   UNL     1       0.860  -5.130  -1.607  1.00  0.00           H  
HETATM   42  H   UNL     1       2.348  -3.249  -2.169  1.00  0.00           H  
HETATM   43  H   UNL     1       5.373   3.013  -0.367  1.00  0.00           H  
HETATM   44  H   UNL     1       7.289   0.954   0.415  1.00  0.00           H  
HETATM   45  H   UNL     1       7.629   3.957  -0.009  1.00  0.00           H  
HETATM   46  H   UNL     1       8.949   2.787   0.227  1.00  0.00           H  
HETATM   47  H   UNL     1       7.928   2.696  -1.229  1.00  0.00           H  
HETATM   48  H   UNL     1       6.683   3.340   2.220  1.00  0.00           H  
HETATM   49  H   UNL     1       6.309   1.639   2.587  1.00  0.00           H  
HETATM   50  H   UNL     1       8.003   2.169   2.455  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.994  -2.781   1.440  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.094  -0.727   0.534  1.00  0.00           H  
HETATM   53  H   UNL     1      -6.186  -0.045   2.246  1.00  0.00           H  
HETATM   54  H   UNL     1      -6.767   2.956  -0.722  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.159   1.745  -1.777  1.00  0.00           H  
CONECT    1    4    3   16                                            
CONECT    2    8   33   33                                            
CONECT    3   17    1   34   35                                       
CONECT    4    5    1   36   37                                       
CONECT    5    6    4   11   38                                       
CONECT    6   27    5   26   26                                       
CONECT    7   28   28   33   27                                       
CONECT    8   32   32    2   39                                       
CONECT    9   30   31   31   29                                       
CONECT   10   29   29   28   40                                       
CONECT   11    5   25   25   14                                       
CONECT   12   23   23   13   41                                       
CONECT   13   14   14   12   42                                       
CONECT   14   11   16   13   13                                       
CONECT   15   16   16                                                 
CONECT   16    1   14   15   15                                       
CONECT   17   19    3   18   18                                       
CONECT   18   17   17                                                 
CONECT   19   17   20   43                                            
CONECT   20   19   22   21   44                                       
CONECT   21   20   45   46   47                                       
CONECT   22   20   48   49   50                                       
CONECT   23   25   24   12   12                                       
CONECT   24   23                                                      
CONECT   25   11   11   23   51                                       
CONECT   26    6    6                                                 
CONECT   27    7    6   52                                            
CONECT   28   32   10    7    7                                       
CONECT   29    9   10   10   53                                       
CONECT   30    9                                                      
CONECT   31    9    9   32   54                                       
CONECT   32   31    8    8   28                                       
CONECT   33    2    2    7   55                                       
CONECT   34    3                                                      
CONECT   35    3                                                      
CONECT   36    4                                                      
CONECT   37    4                                                      
CONECT   38    5                                                      
CONECT   39    8                                                      
CONECT   40   10                                                      
CONECT   41   12                                                      
CONECT   42   13                                                      
CONECT   43   19                                                      
CONECT   44   20                                                      
CONECT   45   21                                                      
CONECT   46   21                                                      
CONECT   47   21                                                      
CONECT   48   22                                                      
CONECT   49   22                                                      
CONECT   50   22                                                      
CONECT   51   25                                                      
CONECT   52   27                                                      
CONECT   53   29                                                      
CONECT   54   31                                                      
CONECT   55   33                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
