COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       2.121  -3.159  -2.201  1.00  0.00           O  
HETATM    2  C   UNL     1       1.811  -3.213  -0.807  1.00  0.00           C  
HETATM    3  C   UNL     1       0.370  -2.705  -0.537  1.00  0.00           C  
HETATM    4  C   UNL     1       0.545  -1.172  -0.498  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.335  -0.582   0.573  1.00  0.00           C  
HETATM    6  N   UNL     1      -1.647  -0.387   0.334  1.00  0.00           N  
HETATM    7  C   UNL     1      -2.504   0.186   1.375  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.915   0.299   0.859  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.800  -0.748   1.032  1.00  0.00           C  
HETATM   10  C   UNL     1      -6.095  -0.645   0.559  1.00  0.00           C  
HETATM   11  C   UNL     1      -6.505   0.507  -0.088  1.00  0.00           C  
HETATM   12 CL   UNL     1      -8.131   0.638  -0.682  1.00  0.00          Cl  
HETATM   13  C   UNL     1      -5.619   1.556  -0.260  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.326   1.453   0.218  1.00  0.00           C  
HETATM   15  O   UNL     1       0.136  -0.283   1.649  1.00  0.00           O  
HETATM   16  N   UNL     1       1.957  -0.902  -0.189  1.00  0.00           N  
HETATM   17  C   UNL     1       2.519   0.318  -0.086  1.00  0.00           C  
HETATM   18  C   UNL     1       3.927   0.450   0.346  1.00  0.00           C  
HETATM   19  C   UNL     1       4.749   1.422  -0.229  1.00  0.00           C  
HETATM   20 CL   UNL     1       4.121   2.482  -1.452  1.00  0.00          Cl  
HETATM   21  C   UNL     1       6.063   1.539   0.180  1.00  0.00           C  
HETATM   22  C   UNL     1       6.565   0.695   1.155  1.00  0.00           C  
HETATM   23  C   UNL     1       5.755  -0.270   1.727  1.00  0.00           C  
HETATM   24  C   UNL     1       4.439  -0.393   1.333  1.00  0.00           C  
HETATM   25  O   UNL     1       1.869   1.311  -0.347  1.00  0.00           O  
HETATM   26  C   UNL     1       2.656  -2.188  -0.010  1.00  0.00           C  
HETATM   27  H   UNL     1       3.011  -3.467  -2.418  1.00  0.00           H  
HETATM   28  H   UNL     1       1.949  -4.221  -0.417  1.00  0.00           H  
HETATM   29  H   UNL     1      -0.299  -2.996  -1.347  1.00  0.00           H  
HETATM   30  H   UNL     1       0.003  -3.075   0.420  1.00  0.00           H  
HETATM   31  H   UNL     1       2.687  -2.460   1.045  1.00  0.00           H  
HETATM   32  H   UNL     1       3.666  -2.131  -0.418  1.00  0.00           H  
HETATM   33  H   UNL     1       0.287  -0.745  -1.467  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.025  -0.626  -0.527  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.489  -0.459   2.254  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.135   1.176   1.645  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.480  -1.648   1.537  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.635   2.273   0.087  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.786  -1.464   0.693  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.938   2.456  -0.765  1.00  0.00           H  
HETATM   41  H   UNL     1       3.807  -1.144   1.785  1.00  0.00           H  
HETATM   42  H   UNL     1       6.701   2.290  -0.263  1.00  0.00           H  
HETATM   43  H   UNL     1       7.593   0.790   1.470  1.00  0.00           H  
HETATM   44  H   UNL     1       6.153  -0.925   2.487  1.00  0.00           H  
CONECT    1    2   27                                                 
CONECT    2    1    3   26   28                                       
CONECT    3    2    4   29   30                                       
CONECT    4    3    5   16   33                                       
CONECT    5    4    6   15   15                                       
CONECT    6    5    7   34                                            
CONECT    7    6    8   35   36                                       
CONECT    8    7    9   14   14                                       
CONECT    9    8   10   10   37                                       
CONECT   10    9    9   11   39                                       
CONECT   11   10   12   13   13                                       
CONECT   12   11                                                      
CONECT   13   11   11   14   40                                       
CONECT   14    8    8   13   38                                       
CONECT   15    5    5                                                 
CONECT   16    4   17   26                                            
CONECT   17   16   18   25   25                                       
CONECT   18   17   19   24   24                                       
CONECT   19   18   20   21   21                                       
CONECT   20   19                                                      
CONECT   21   19   19   22   42                                       
CONECT   22   21   23   23   43                                       
CONECT   23   22   22   24   44                                       
CONECT   24   18   18   23   41                                       
CONECT   25   17   17                                                 
CONECT   26    2   16   31   32                                       
CONECT   27    1                                                      
CONECT   28    2                                                      
CONECT   29    3                                                      
CONECT   30    3                                                      
CONECT   31   26                                                      
CONECT   32   26                                                      
CONECT   33    4                                                      
CONECT   34    6                                                      
CONECT   35    7                                                      
CONECT   36    7                                                      
CONECT   37    9                                                      
CONECT   38   14                                                      
CONECT   39   10                                                      
CONECT   40   13                                                      
CONECT   41   24                                                      
CONECT   42   21                                                      
CONECT   43   22                                                      
CONECT   44   23                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
