COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       5.071  -0.587  -0.814  1.00  0.00           N  
HETATM    2  C   UNL     1      -0.917   1.563   0.020  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.132   1.159   0.481  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.426   0.456   0.802  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.133   0.070  -0.499  1.00  0.00           C  
HETATM    6  C   UNL     1      -6.427  -0.633  -0.178  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.377  -0.797   0.352  1.00  0.00           C  
HETATM    8  C   UNL     1       5.049   0.909   0.996  1.00  0.00           C  
HETATM    9  C   UNL     1       6.957  -0.457   0.578  1.00  0.00           C  
HETATM   10 CL   UNL     1       0.498  -2.721   0.210  1.00  0.00          Cl  
HETATM   11  C   UNL     1      -0.056  -1.077   0.144  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.824   0.526   0.299  1.00  0.00           C  
HETATM   13  O   UNL     1      -6.750  -0.808   0.973  1.00  0.00           O  
HETATM   14  O   UNL     1      -7.220  -1.066  -1.171  1.00  0.00           O  
HETATM   15  N   UNL     1      -2.973   2.436   0.316  1.00  0.00           N  
HETATM   16  O   UNL     1      -1.618   2.715   0.027  1.00  0.00           O  
HETATM   17  C   UNL     1       0.420   1.261  -0.202  1.00  0.00           C  
HETATM   18  C   UNL     1       0.847  -0.054  -0.140  1.00  0.00           C  
HETATM   19  O   UNL     1       2.157  -0.347  -0.344  1.00  0.00           O  
HETATM   20  C   UNL     1       3.053   0.756  -0.498  1.00  0.00           C  
HETATM   21  C   UNL     1       3.053   1.213  -1.957  1.00  0.00           C  
HETATM   22  C   UNL     1       4.444   0.331  -0.104  1.00  0.00           C  
HETATM   23  C   UNL     1       6.289  -0.989  -0.508  1.00  0.00           C  
HETATM   24  C   UNL     1       6.330   0.511   1.349  1.00  0.00           C  
HETATM   25  H   UNL     1      -4.217  -0.443   1.382  1.00  0.00           H  
HETATM   26  H   UNL     1      -5.067   1.121   1.381  1.00  0.00           H  
HETATM   27  H   UNL     1      -5.342   0.969  -1.079  1.00  0.00           H  
HETATM   28  H   UNL     1      -4.492  -0.595  -1.077  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.071  -1.595   0.571  1.00  0.00           H  
HETATM   30  H   UNL     1       4.531   1.660   1.573  1.00  0.00           H  
HETATM   31  H   UNL     1       7.954  -0.790   0.825  1.00  0.00           H  
HETATM   32  H   UNL     1      -8.040  -1.511  -0.915  1.00  0.00           H  
HETATM   33  H   UNL     1       1.124   2.049  -0.423  1.00  0.00           H  
HETATM   34  H   UNL     1       2.730   1.578   0.141  1.00  0.00           H  
HETATM   35  H   UNL     1       3.376   0.391  -2.596  1.00  0.00           H  
HETATM   36  H   UNL     1       2.046   1.520  -2.242  1.00  0.00           H  
HETATM   37  H   UNL     1       3.736   2.055  -2.075  1.00  0.00           H  
HETATM   38  H   UNL     1       6.770  -1.743  -1.113  1.00  0.00           H  
HETATM   39  H   UNL     1       6.828   0.945   2.203  1.00  0.00           H  
CONECT    1   23   23   22                                            
CONECT    2   12   12   17   16                                       
CONECT    3    4   12   15   15                                       
CONECT    4    5    3   25   26                                       
CONECT    5    6    4   27   28                                       
CONECT    6   13   13   14    5                                       
CONECT    7   11   11   12   29                                       
CONECT    8   24   22   22   30                                       
CONECT    9   24   24   23   31                                       
CONECT   10   11                                                      
CONECT   11   10    7    7   18                                       
CONECT   12    7    3    2    2                                       
CONECT   13    6    6                                                 
CONECT   14    6   32                                                 
CONECT   15    3    3   16                                            
CONECT   16    2   15                                                 
CONECT   17   18   18    2   33                                       
CONECT   18   11   19   17   17                                       
CONECT   19   18   20                                                 
CONECT   20   19   22   21   34                                       
CONECT   21   20   35   36   37                                       
CONECT   22    8    8    1   20                                       
CONECT   23    9    1    1   38                                       
CONECT   24    9    9    8   39                                       
CONECT   25    4                                                      
CONECT   26    4                                                      
CONECT   27    5                                                      
CONECT   28    5                                                      
CONECT   29    7                                                      
CONECT   30    8                                                      
CONECT   31    9                                                      
CONECT   32   14                                                      
CONECT   33   17                                                      
CONECT   34   20                                                      
CONECT   35   21                                                      
CONECT   36   21                                                      
CONECT   37   21                                                      
CONECT   38   23                                                      
CONECT   39   24                                                      
MASTER        0    0    0    0    0    0    0    0   39    0   39    0
END
