COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.038  -0.230   0.269  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.097   1.742  -0.966  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.941   0.228   2.752  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.064  -2.193   1.814  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.062  -1.725  -0.089  1.00  0.00           C  
HETATM    6  C   UNL     1       2.542   1.614  -0.477  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.648   1.983   1.291  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.226   0.710   1.434  1.00  0.00           C  
HETATM    9  N   UNL     1      -1.716  -0.154   3.798  1.00  0.00           N  
HETATM   10  C   UNL     1      -2.709  -1.571   0.574  1.00  0.00           C  
HETATM   11  C   UNL     1       1.286  -1.926  -0.324  1.00  0.00           C  
HETATM   12 CL   UNL     1       4.141   0.362   1.329  1.00  0.00          Cl  
HETATM   13  C   UNL     1       3.728   1.662   0.255  1.00  0.00           C  
HETATM   14  C   UNL     1       4.573   2.747   0.125  1.00  0.00           C  
HETATM   15  C   UNL     1       4.245   3.783  -0.730  1.00  0.00           C  
HETATM   16  C   UNL     1       3.070   3.740  -1.459  1.00  0.00           C  
HETATM   17  C   UNL     1       2.217   2.661  -1.337  1.00  0.00           C  
HETATM   18  C   UNL     1       1.632   0.449  -0.346  1.00  0.00           C  
HETATM   19  C   UNL     1       2.135  -0.846  -0.453  1.00  0.00           C  
HETATM   20  C   UNL     1       1.828  -3.328  -0.440  1.00  0.00           C  
HETATM   21  F   UNL     1       1.772  -3.741  -1.775  1.00  0.00           F  
HETATM   22  F   UNL     1       3.155  -3.352   0.001  1.00  0.00           F  
HETATM   23  F   UNL     1       1.060  -4.191   0.348  1.00  0.00           F  
HETATM   24  C   UNL     1       0.274   0.646  -0.104  1.00  0.00           C  
HETATM   25  C   UNL     1      -0.567  -0.441   0.019  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.200  -1.348   0.832  1.00  0.00           C  
HETATM   27  N   UNL     1      -2.777   2.744   2.426  1.00  0.00           N  
HETATM   28  C   UNL     1      -2.677   0.394  -0.945  1.00  0.00           C  
HETATM   29  C   UNL     1      -2.951  -0.147  -2.141  1.00  0.00           C  
HETATM   30  C   UNL     1      -2.672  -1.567  -2.560  1.00  0.00           C  
HETATM   31  N   UNL     1      -3.524   0.813  -2.904  1.00  0.00           N  
HETATM   32  N   UNL     1      -3.603   1.988  -2.140  1.00  0.00           N  
HETATM   33  O   UNL     1      -2.955   2.559   0.112  1.00  0.00           O  
HETATM   34  H   UNL     1      -2.224  -3.271   1.805  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.994  -1.985   1.811  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.514  -1.767   2.711  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.724  -2.573   0.007  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.583  -2.241  -0.276  1.00  0.00           H  
HETATM   39  H   UNL     1       5.492   2.786   0.691  1.00  0.00           H  
HETATM   40  H   UNL     1       4.908   4.630  -0.829  1.00  0.00           H  
HETATM   41  H   UNL     1       2.818   4.552  -2.125  1.00  0.00           H  
HETATM   42  H   UNL     1       1.301   2.629  -1.907  1.00  0.00           H  
HETATM   43  H   UNL     1       3.188  -1.004  -0.636  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.119   1.648  -0.013  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.646  -0.845  -0.026  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.690  -2.309   0.986  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.326  -0.730   1.721  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.079   3.664   2.362  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.565   2.363   3.293  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.491  -2.209  -2.235  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.582  -1.615  -3.645  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.742  -1.905  -2.103  1.00  0.00           H  
HETATM   53  H   UNL     1      -3.828   0.707  -3.819  1.00  0.00           H  
CONECT    1    8   10   25   28                                       
CONECT    2   33   28   32   32                                       
CONECT    3    9    9    9    8                                       
CONECT    4   10   34   35   36                                       
CONECT    5   11   11   25   37                                       
CONECT    6   18   17   17   13                                       
CONECT    7   27    8    8   33                                       
CONECT    8    3    7    7    1                                       
CONECT    9    3    3    3                                            
CONECT   10   26    4    1   38                                       
CONECT   11   20    5    5   19                                       
CONECT   12   13                                                      
CONECT   13    6   12   14   14                                       
CONECT   14   13   13   15   39                                       
CONECT   15   16   16   14   40                                       
CONECT   16   17   15   15   41                                       
CONECT   17    6    6   16   42                                       
CONECT   18   19   19   24    6                                       
CONECT   19   11   18   18   43                                       
CONECT   20   22   23   21   11                                       
CONECT   21   20                                                      
CONECT   22   20                                                      
CONECT   23   20                                                      
CONECT   24   25   25   18   44                                       
CONECT   25    5    1   24   24                                       
CONECT   26   10   45   46   47                                       
CONECT   27    7   48   49                                            
CONECT   28    1    2   29   29                                       
CONECT   29   28   28   30   31                                       
CONECT   30   29   50   51   52                                       
CONECT   31   29   32   53                                            
CONECT   32    2    2   31                                            
CONECT   33    7    2                                                 
CONECT   34    4                                                      
CONECT   35    4                                                      
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38   10                                                      
CONECT   39   14                                                      
CONECT   40   15                                                      
CONECT   41   16                                                      
CONECT   42   17                                                      
CONECT   43   19                                                      
CONECT   44   24                                                      
CONECT   45   26                                                      
CONECT   46   26                                                      
CONECT   47   26                                                      
CONECT   48   27                                                      
CONECT   49   27                                                      
CONECT   50   30                                                      
CONECT   51   30                                                      
CONECT   52   30                                                      
CONECT   53   31                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
