COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.006   2.540  -0.270  1.00  0.00           C  
HETATM    2  C   UNL     1       2.750  -0.419   0.376  1.00  0.00           C  
HETATM    3  C   UNL     1       0.408   3.843  -0.595  1.00  0.00           C  
HETATM    4  C   UNL     1       2.290   1.867  -0.089  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.474   2.557  -0.281  1.00  0.00           C  
HETATM    6  C   UNL     1       0.948   1.553  -0.014  1.00  0.00           C  
HETATM    7  C   UNL     1       3.840  -1.402   0.035  1.00  0.00           C  
HETATM    8  C   UNL     1       1.768   4.136  -0.664  1.00  0.00           C  
HETATM    9  C   UNL     1       2.691   3.161  -0.416  1.00  0.00           C  
HETATM   10  C   UNL     1       2.353  -0.586   1.844  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.361   1.417   0.002  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.582   0.432   0.240  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.694   1.575  -0.043  1.00  0.00           C  
HETATM   14  C   UNL     1      -7.773  -1.234   0.644  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.960   0.446   0.231  1.00  0.00           C  
HETATM   16  C   UNL     1       3.564  -2.534  -0.719  1.00  0.00           C  
HETATM   17  C   UNL     1       5.143  -1.195   0.462  1.00  0.00           C  
HETATM   18  N   UNL     1      -0.730   4.588  -0.787  1.00  0.00           N  
HETATM   19  N   UNL     1      -1.852   3.778  -0.588  1.00  0.00           N  
HETATM   20  N   UNL     1      -6.378  -0.798   0.541  1.00  0.00           N  
HETATM   21  N   UNL     1      -5.251  -1.603   0.747  1.00  0.00           N  
HETATM   22  N   UNL     1       5.817  -3.187  -0.585  1.00  0.00           N  
HETATM   23  O   UNL     1       3.224   0.912   0.160  1.00  0.00           O  
HETATM   24  O   UNL     1      -9.362  -2.861  -0.172  1.00  0.00           O  
HETATM   25  C   UNL     1      -4.178  -0.882   0.565  1.00  0.00           C  
HETATM   26  C   UNL     1      -8.001  -2.436  -0.273  1.00  0.00           C  
HETATM   27  C   UNL     1       4.591  -3.414  -1.012  1.00  0.00           C  
HETATM   28  C   UNL     1       6.117  -2.119   0.129  1.00  0.00           C  
HETATM   29 CL   UNL     1       1.953  -2.843  -1.285  1.00  0.00          Cl  
HETATM   30 CL   UNL     1       5.548   0.208   1.402  1.00  0.00          Cl  
HETATM   31  H   UNL     1       1.883  -0.603  -0.258  1.00  0.00           H  
HETATM   32  H   UNL     1       0.639   0.550   0.242  1.00  0.00           H  
HETATM   33  H   UNL     1       2.093   5.136  -0.913  1.00  0.00           H  
HETATM   34  H   UNL     1       3.744   3.396  -0.472  1.00  0.00           H  
HETATM   35  H   UNL     1       1.991  -1.601   2.009  1.00  0.00           H  
HETATM   36  H   UNL     1       3.220  -0.403   2.478  1.00  0.00           H  
HETATM   37  H   UNL     1       1.565   0.125   2.091  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.939   0.453   0.246  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.115   2.539  -0.287  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.990  -1.516   1.674  1.00  0.00           H  
HETATM   41  H   UNL     1      -8.431  -0.418   0.345  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.590   1.296   0.015  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.752   5.529  -1.023  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.159  -1.228   0.654  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.784  -2.154  -1.304  1.00  0.00           H  
HETATM   46  H   UNL     1       4.384  -4.300  -1.594  1.00  0.00           H  
HETATM   47  H   UNL     1       7.133  -1.967   0.461  1.00  0.00           H  
HETATM   48  H   UNL     1      -9.579  -3.622  -0.729  1.00  0.00           H  
HETATM   49  H   UNL     1      -7.343  -3.252   0.026  1.00  0.00           H  
CONECT    1    6    5    3    3                                       
CONECT    2    7   10   23   31                                       
CONECT    3    1    1    8   18                                       
CONECT    4   23    6    6    9                                       
CONECT    5    1   11   19   19                                       
CONECT    6    4    4    1   32                                       
CONECT    7   16   16   17    2                                       
CONECT    8    9    9    3   33                                       
CONECT    9    4    8    8   34                                       
CONECT   10    2   35   36   37                                       
CONECT   11   13   13    5   38                                       
CONECT   12   25   13   15   15                                       
CONECT   13   12   11   11   39                                       
CONECT   14   20   26   40   41                                       
CONECT   15   20   12   12   42                                       
CONECT   16   27   29    7    7                                       
CONECT   17   28   28    7   30                                       
CONECT   18    3   19   43                                            
CONECT   19    5    5   18                                            
CONECT   20   21   14   15                                            
CONECT   21   25   25   20                                            
CONECT   22   27   27   28                                            
CONECT   23    2    4                                                 
CONECT   24   26   48                                                 
CONECT   25   21   21   12   44                                       
CONECT   26   14   24   45   49                                       
CONECT   27   22   22   16   46                                       
CONECT   28   22   17   17   47                                       
CONECT   29   16                                                      
CONECT   30   17                                                      
CONECT   31    2                                                      
CONECT   32    6                                                      
CONECT   33    8                                                      
CONECT   34    9                                                      
CONECT   35   10                                                      
CONECT   36   10                                                      
CONECT   37   10                                                      
CONECT   38   11                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   14                                                      
CONECT   42   15                                                      
CONECT   43   18                                                      
CONECT   44   25                                                      
CONECT   45   26                                                      
CONECT   46   27                                                      
CONECT   47   28                                                      
CONECT   48   24                                                      
CONECT   49   26                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
