COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.761   0.521  -0.824  1.00  0.00           C  
HETATM    2  C   UNL     1       1.452  -0.663  -1.003  1.00  0.00           C  
HETATM    3  C   UNL     1       2.766  -0.766  -0.588  1.00  0.00           C  
HETATM    4  C   UNL     1       3.390   0.316   0.007  1.00  0.00           C  
HETATM    5  C   UNL     1       2.698   1.501   0.186  1.00  0.00           C  
HETATM    6  C   UNL     1       1.384   1.602  -0.230  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.670   0.634  -1.283  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.605   0.215  -0.147  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.368   0.904  -0.199  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.918   0.892   0.210  1.00  0.00           C  
HETATM   11  N   UNL     1      -2.996   0.325  -0.593  1.00  0.00           N  
HETATM   12  O   UNL     1      -3.581   1.392   1.263  1.00  0.00           O  
HETATM   13  O   UNL     1      -0.054  -1.370   0.832  1.00  0.00           O  
HETATM   14  O   UNL     1      -2.233  -1.725   1.164  1.00  0.00           O  
HETATM   15  O   UNL     1      -1.336  -2.090  -0.847  1.00  0.00           O  
HETATM   16  B   UNL     1      -1.296  -1.297   0.266  1.00  0.00           B1-
HETATM   17 CL   UNL     1       5.041   0.187   0.530  1.00  0.00          Cl  
HETATM   18  H   UNL     1       0.965  -1.508  -1.467  1.00  0.00           H  
HETATM   19  H   UNL     1       3.306  -1.691  -0.727  1.00  0.00           H  
HETATM   20  H   UNL     1       3.185   2.345   0.651  1.00  0.00           H  
HETATM   21  H   UNL     1       0.844   2.527  -0.090  1.00  0.00           H  
HETATM   22  H   UNL     1      -0.880   1.666  -1.564  1.00  0.00           H  
HETATM   23  H   UNL     1      -0.828  -0.016  -2.143  1.00  0.00           H  
HETATM   24  H   UNL     1      -1.446   0.865   0.713  1.00  0.00           H  
HETATM   25  H   UNL     1      -5.477   0.413  -1.166  1.00  0.00           H  
HETATM   26  H   UNL     1      -5.961   0.373   0.546  1.00  0.00           H  
HETATM   27  H   UNL     1      -5.716   1.934  -0.274  1.00  0.00           H  
HETATM   28  H   UNL     1      -3.253  -0.010  -1.466  1.00  0.00           H  
HETATM   29  H   UNL     1       0.200  -2.262   1.108  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.261  -1.206   1.980  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.696  -1.844  -1.529  1.00  0.00           H  
CONECT    1    2    2    6    7                                       
CONECT    2    1    1    3   18                                       
CONECT    3    2    4    4   19                                       
CONECT    4    3    3    5   17                                       
CONECT    5    4    6    6   20                                       
CONECT    6    1    5    5   21                                       
CONECT    7    1    8   22   23                                       
CONECT    8    7   11   16   24                                       
CONECT    9   10   25   26   27                                       
CONECT   10    9   11   12   12                                       
CONECT   11    8   10   28                                            
CONECT   12   10   10                                                 
CONECT   13   16   29                                                 
CONECT   14   16   30                                                 
CONECT   15   16   31                                                 
CONECT   16    8   13   14   15                                       
CONECT   17    4                                                      
CONECT   18    2                                                      
CONECT   19    3                                                      
CONECT   20    5                                                      
CONECT   21    6                                                      
CONECT   22    7                                                      
CONECT   23    7                                                      
CONECT   24    8                                                      
CONECT   25    9                                                      
CONECT   26    9                                                      
CONECT   27    9                                                      
CONECT   28   11                                                      
CONECT   29   13                                                      
CONECT   30   14                                                      
CONECT   31   15                                                      
MASTER        0    0    0    0    0    0    0    0   31    0   31    0
END
