COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1 CL   UNL     1       3.045  -2.003  -0.656  1.00  0.00          Cl  
HETATM    2  C   UNL     1       3.896  -0.531  -0.308  1.00  0.00           C  
HETATM    3  C   UNL     1       5.116  -0.278  -0.909  1.00  0.00           C  
HETATM    4  C   UNL     1       5.793   0.894  -0.632  1.00  0.00           C  
HETATM    5  C   UNL     1       5.252   1.814   0.246  1.00  0.00           C  
HETATM    6  C   UNL     1       4.033   1.562   0.848  1.00  0.00           C  
HETATM    7  C   UNL     1       3.352   0.393   0.566  1.00  0.00           C  
HETATM    8  C   UNL     1       2.023   0.119   1.222  1.00  0.00           C  
HETATM    9  N   UNL     1       0.947   0.325   0.250  1.00  0.00           N  
HETATM   10  C   UNL     1      -0.337   0.136   0.615  1.00  0.00           C  
HETATM   11  O   UNL     1      -0.601  -0.205   1.752  1.00  0.00           O  
HETATM   12  N   UNL     1      -1.327   0.326  -0.280  1.00  0.00           N  
HETATM   13  C   UNL     1      -2.722   0.121   0.118  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.636   0.953  -0.784  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.364   2.441  -0.553  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.188   3.269  -1.541  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.757   2.815   0.878  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.074  -1.338  -0.019  1.00  0.00           C  
HETATM   19  O   UNL     1      -2.241  -2.128  -0.410  1.00  0.00           O  
HETATM   20  N   UNL     1      -4.314  -1.764   0.292  1.00  0.00           N  
HETATM   21  O   UNL     1      -4.645  -3.135   0.164  1.00  0.00           O  
HETATM   22  H   UNL     1       5.539  -0.997  -1.595  1.00  0.00           H  
HETATM   23  H   UNL     1       6.746   1.091  -1.101  1.00  0.00           H  
HETATM   24  H   UNL     1       5.782   2.730   0.463  1.00  0.00           H  
HETATM   25  H   UNL     1       3.608   2.284   1.530  1.00  0.00           H  
HETATM   26  H   UNL     1       1.999  -0.911   1.577  1.00  0.00           H  
HETATM   27  H   UNL     1       1.886   0.797   2.065  1.00  0.00           H  
HETATM   28  H   UNL     1       1.158   0.598  -0.657  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.116   0.599  -1.186  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.854   0.431   1.154  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.441   0.706  -1.827  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.678   0.733  -0.548  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.304   2.644  -0.703  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.994   4.329  -1.376  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.908   3.003  -2.560  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.248   3.066  -1.390  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.171   2.224   1.582  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.563   3.874   1.043  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.818   2.611   1.028  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.980  -1.132   0.605  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.556  -3.345   0.410  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    7    1    3    3                                       
CONECT    3    2    2    4   22                                       
CONECT    4    5    5    3   23                                       
CONECT    5    6    4    4   24                                       
CONECT    6    7    7    5   25                                       
CONECT    7    8    6    6    2                                       
CONECT    8    9    7   26   27                                       
CONECT    9   10    8   28                                            
CONECT   10   12   11   11    9                                       
CONECT   11   10   10                                                 
CONECT   12   13   10   29                                            
CONECT   13   18   14   12   30                                       
CONECT   14   15   13   31   32                                       
CONECT   15   16   17   14   33                                       
CONECT   16   15   34   35   36                                       
CONECT   17   15   37   38   39                                       
CONECT   18   20   19   19   13                                       
CONECT   19   18   18                                                 
CONECT   20   21   18   40                                            
CONECT   21   20   41                                                 
CONECT   22    3                                                      
CONECT   23    4                                                      
CONECT   24    5                                                      
CONECT   25    6                                                      
CONECT   26    8                                                      
CONECT   27    8                                                      
CONECT   28    9                                                      
CONECT   29   12                                                      
CONECT   30   13                                                      
CONECT   31   14                                                      
CONECT   32   14                                                      
CONECT   33   15                                                      
CONECT   34   16                                                      
CONECT   35   16                                                      
CONECT   36   16                                                      
CONECT   37   17                                                      
CONECT   38   17                                                      
CONECT   39   17                                                      
CONECT   40   20                                                      
CONECT   41   21                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
