COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.040  -3.897   1.030  1.00  0.00           C  
HETATM    2  N   UNL     1       2.266  -1.602   0.489  1.00  0.00           N  
HETATM    3  O   UNL     1      -3.724   2.059   1.381  1.00  0.00           O  
HETATM    4  C   UNL     1      -4.898   2.102   1.080  1.00  0.00           C  
HETATM    5  N   UNL     1      -5.680   3.090   1.556  1.00  0.00           N  
HETATM    6  C   UNL     1      -5.482   1.049   0.173  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.406   0.068  -0.215  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.640   0.292  -1.344  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.655  -0.609  -1.701  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.181  -1.055   0.560  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.196  -1.956   0.203  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.435  -1.734  -0.930  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.361  -2.717  -1.320  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.060  -2.324  -0.668  1.00  0.00           C  
HETATM   15  C   UNL     1       0.632  -3.232   0.121  1.00  0.00           C  
HETATM   16  C   UNL     1       1.826  -2.830   0.702  1.00  0.00           C  
HETATM   17  C   UNL     1       2.612  -3.783   1.566  1.00  0.00           C  
HETATM   18  N   UNL     1       0.435  -1.111  -0.840  1.00  0.00           N  
HETATM   19  C   UNL     1       1.580  -0.758  -0.270  1.00  0.00           C  
HETATM   20  C   UNL     1       2.105   0.612  -0.487  1.00  0.00           C  
HETATM   21  C   UNL     1       3.305   1.002   0.103  1.00  0.00           C  
HETATM   22  C   UNL     1       3.789   2.279  -0.102  1.00  0.00           C  
HETATM   23 CL   UNL     1       5.285   2.768   0.632  1.00  0.00          Cl  
HETATM   24  C   UNL     1       1.402   1.512  -1.286  1.00  0.00           C  
HETATM   25  C   UNL     1       1.897   2.784  -1.489  1.00  0.00           C  
HETATM   26  C   UNL     1       3.083   3.170  -0.892  1.00  0.00           C  
HETATM   27  H   UNL     1       4.608  -4.586   1.654  1.00  0.00           H  
HETATM   28  H   UNL     1       4.015  -4.271   0.006  1.00  0.00           H  
HETATM   29  H   UNL     1       4.514  -2.916   1.046  1.00  0.00           H  
HETATM   30  H   UNL     1      -5.304   3.768   2.139  1.00  0.00           H  
HETATM   31  H   UNL     1      -6.619   3.124   1.315  1.00  0.00           H  
HETATM   32  H   UNL     1      -6.282   0.523   0.695  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.882   1.522  -0.723  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.813   1.171  -1.947  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.057  -0.433  -2.583  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.777  -1.228   1.445  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.021  -2.833   0.808  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.645  -3.716  -0.990  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.240  -2.712  -2.403  1.00  0.00           H  
HETATM   40  H   UNL     1       0.250  -4.229   0.279  1.00  0.00           H  
HETATM   41  H   UNL     1       2.137  -4.764   1.549  1.00  0.00           H  
HETATM   42  H   UNL     1       2.636  -3.408   2.589  1.00  0.00           H  
HETATM   43  H   UNL     1       3.856   0.307   0.720  1.00  0.00           H  
HETATM   44  H   UNL     1       0.471   1.214  -1.746  1.00  0.00           H  
HETATM   45  H   UNL     1       1.351   3.483  -2.105  1.00  0.00           H  
HETATM   46  H   UNL     1       3.467   4.167  -1.054  1.00  0.00           H  
CONECT    1   17   27   28   29                                       
CONECT    2   19   19   16                                            
CONECT    3    4    4                                                 
CONECT    4    5    3    3    6                                       
CONECT    5    4   30   31                                            
CONECT    6    4    7   32   33                                       
CONECT    7    8    6   10   10                                       
CONECT    8    9    9    7   34                                       
CONECT    9    8    8   12   35                                       
CONECT   10    7    7   11   36                                       
CONECT   11   12   12   10   37                                       
CONECT   12    9   13   11   11                                       
CONECT   13   14   12   38   39                                       
CONECT   14   18   18   15   13                                       
CONECT   15   16   16   14   40                                       
CONECT   16    2   17   15   15                                       
CONECT   17    1   16   41   42                                       
CONECT   18   19   14   14                                            
CONECT   19   20    2    2   18                                       
CONECT   20   24   24   21   19                                       
CONECT   21   22   22   20   43                                       
CONECT   22   26   23   21   21                                       
CONECT   23   22                                                      
CONECT   24   25   20   20   44                                       
CONECT   25   26   26   24   45                                       
CONECT   26   25   25   22   46                                       
CONECT   27    1                                                      
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    5                                                      
CONECT   31    5                                                      
CONECT   32    6                                                      
CONECT   33    6                                                      
CONECT   34    8                                                      
CONECT   35    9                                                      
CONECT   36   10                                                      
CONECT   37   11                                                      
CONECT   38   13                                                      
CONECT   39   13                                                      
CONECT   40   15                                                      
CONECT   41   17                                                      
CONECT   42   17                                                      
CONECT   43   21                                                      
CONECT   44   24                                                      
CONECT   45   25                                                      
CONECT   46   26                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
