COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.944   1.581   0.530  1.00  0.00           C  
HETATM    2  C   UNL     1       3.136   1.089   0.024  1.00  0.00           C  
HETATM    3  C   UNL     1       3.321  -0.280  -0.056  1.00  0.00           C  
HETATM    4 CL   UNL     1       4.811  -0.909  -0.687  1.00  0.00          Cl  
HETATM    5  N   UNL     1       2.378  -1.112   0.341  1.00  0.00           N  
HETATM    6  C   UNL     1       1.231  -0.679   0.827  1.00  0.00           C  
HETATM    7  C   UNL     1       0.976   0.674   0.937  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.336   1.160   1.499  1.00  0.00           C  
HETATM    9  N   UNL     1      -1.302   1.325   0.411  1.00  0.00           N  
HETATM   10  C   UNL     1      -1.503   2.553  -0.373  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.619   2.179  -1.367  1.00  0.00           C  
HETATM   12  N   UNL     1      -2.930   0.780  -1.040  1.00  0.00           N  
HETATM   13  C   UNL     1      -2.140   0.377  -0.034  1.00  0.00           C  
HETATM   14  N   UNL     1      -2.188  -0.864   0.486  1.00  0.00           N  
HETATM   15  N   UNL     1      -3.086  -1.698   0.084  1.00  0.00           N1+
HETATM   16  O   UNL     1      -4.193  -1.693   0.592  1.00  0.00           O  
HETATM   17  O   UNL     1      -2.827  -2.490  -0.804  1.00  0.00           O1-
HETATM   18  H   UNL     1       1.773   2.644   0.609  1.00  0.00           H  
HETATM   19  H   UNL     1       3.912   1.766  -0.303  1.00  0.00           H  
HETATM   20  H   UNL     1       0.482  -1.390   1.143  1.00  0.00           H  
HETATM   21  H   UNL     1      -0.716   0.433   2.216  1.00  0.00           H  
HETATM   22  H   UNL     1      -0.184   2.117   1.999  1.00  0.00           H  
HETATM   23  H   UNL     1      -1.824   3.370   0.273  1.00  0.00           H  
HETATM   24  H   UNL     1      -0.590   2.820  -0.905  1.00  0.00           H  
HETATM   25  H   UNL     1      -3.494   2.811  -1.215  1.00  0.00           H  
HETATM   26  H   UNL     1      -2.261   2.264  -2.393  1.00  0.00           H  
HETATM   27  H   UNL     1      -3.597   0.234  -1.484  1.00  0.00           H  
CONECT    1    7   18    2    2                                       
CONECT    2    1    1    3   19                                       
CONECT    3    2    5    5    4                                       
CONECT    4    3                                                      
CONECT    5    3    3    6                                            
CONECT    6    5   20    7    7                                       
CONECT    7    1    6    6    8                                       
CONECT    8    7    9   21   22                                       
CONECT    9    8   13   10                                            
CONECT   10    9   11   23   24                                       
CONECT   11   10   12   25   26                                       
CONECT   12   11   13   27                                            
CONECT   13    9   12   14   14                                       
CONECT   14   13   13   15                                            
CONECT   15   14   17   16   16                                       
CONECT   16   15   15                                                 
CONECT   17   15                                                      
CONECT   18    1                                                      
CONECT   19    2                                                      
CONECT   20    6                                                      
CONECT   21    8                                                      
CONECT   22    8                                                      
CONECT   23   10                                                      
CONECT   24   10                                                      
CONECT   25   11                                                      
CONECT   26   11                                                      
CONECT   27   12                                                      
MASTER        0    0    0    0    0    0    0    0   27    0   27    0
END
