COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.396  -1.699  -0.749  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.090   1.822  -0.517  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.931   1.441  -2.233  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.402   0.556  -0.211  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.447   0.108   1.111  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.537  -0.584   1.557  1.00  0.00           C  
HETATM    7  C   UNL     1       3.678   2.171   0.980  1.00  0.00           C  
HETATM    8  C   UNL     1       3.579   0.830   0.380  1.00  0.00           C  
HETATM    9  C   UNL     1       4.693  -0.016   0.362  1.00  0.00           C  
HETATM   10  C   UNL     1       4.594  -1.269  -0.200  1.00  0.00           C  
HETATM   11  C   UNL     1       2.288  -0.877  -0.739  1.00  0.00           C  
HETATM   12  C   UNL     1       2.367   0.391  -0.177  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.039   0.717  -0.634  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.421   1.304  -0.999  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.479   0.294  -1.077  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.603  -0.847   0.705  1.00  0.00           C  
HETATM   17  C   UNL     1      -5.579  -0.414  -0.603  1.00  0.00           C  
HETATM   18  N   UNL     1       5.774  -2.163  -0.219  1.00  0.00           N1+
HETATM   19  N   UNL     1       1.254   1.220  -0.165  1.00  0.00           N  
HETATM   20  N   UNL     1      -4.162   0.847  -2.298  1.00  0.00           N  
HETATM   21  O   UNL     1       2.742   2.942   0.900  1.00  0.00           O  
HETATM   22  O   UNL     1       4.805   2.543   1.618  1.00  0.00           O  
HETATM   23  O   UNL     1       6.829  -1.789   0.263  1.00  0.00           O  
HETATM   24  O   UNL     1       5.691  -3.272  -0.715  1.00  0.00           O1-
HETATM   25 CL   UNL     1      -6.977  -1.729   1.294  1.00  0.00          Cl  
HETATM   26  H   UNL     1       3.330  -2.682  -1.192  1.00  0.00           H  
HETATM   27  H   UNL     1      -1.177   2.132   0.525  1.00  0.00           H  
HETATM   28  H   UNL     1      -0.790   2.675  -1.125  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.444   1.950  -3.053  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.621   0.307   1.779  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.570  -0.931   2.579  1.00  0.00           H  
HETATM   32  H   UNL     1       5.629   0.313   0.788  1.00  0.00           H  
HETATM   33  H   UNL     1       1.358  -1.219  -1.169  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.340  -0.136  -0.025  1.00  0.00           H  
HETATM   35  H   UNL     1       0.047   0.407  -1.676  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.412  -0.622  -1.258  1.00  0.00           H  
HETATM   37  H   UNL     1       1.332   2.133   0.154  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.726   0.817  -3.086  1.00  0.00           H  
HETATM   39  H   UNL     1       4.822   3.434   1.995  1.00  0.00           H  
CONECT    1   11   11   10   26                                       
CONECT    2   13   14   27   28                                       
CONECT    3   14   14   20   29                                       
CONECT    4    5   15   15   14                                       
CONECT    5    6    6    4   30                                       
CONECT    6   16    5    5   31                                       
CONECT    7    8   21   21   22                                       
CONECT    8   12   12    9    7                                       
CONECT    9   10   10    8   32                                       
CONECT   10    1   18    9    9                                       
CONECT   11    1    1   12   33                                       
CONECT   12   11   19    8    8                                       
CONECT   13   19    2   34   35                                       
CONECT   14    4    2    3    3                                       
CONECT   15   17    4    4   20                                       
CONECT   16   25    6   17   17                                       
CONECT   17   16   16   15   36                                       
CONECT   18   23   23   10   24                                       
CONECT   19   13   12   37                                            
CONECT   20   15    3   38                                            
CONECT   21    7    7                                                 
CONECT   22    7   39                                                 
CONECT   23   18   18                                                 
CONECT   24   18                                                      
CONECT   25   16                                                      
CONECT   26    1                                                      
CONECT   27    2                                                      
CONECT   28    2                                                      
CONECT   29    3                                                      
CONECT   30    5                                                      
CONECT   31    6                                                      
CONECT   32    9                                                      
CONECT   33   11                                                      
CONECT   34   13                                                      
CONECT   35   13                                                      
CONECT   36   17                                                      
CONECT   37   19                                                      
CONECT   38   20                                                      
CONECT   39   22                                                      
MASTER        0    0    0    0    0    0    0    0   39    0   39    0
END
