COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.745   1.637   1.934  1.00  0.00           C  
HETATM    2  N   UNL     1       5.885  -0.190  -1.766  1.00  0.00           N  
HETATM    3  C   UNL     1       4.907   0.626   1.560  1.00  0.00           C  
HETATM    4  N   UNL     1       0.711  -1.644   0.288  1.00  0.00           N  
HETATM    5  C   UNL     1       5.023   0.064   0.287  1.00  0.00           C  
HETATM    6  N   UNL     1      -0.495  -0.960   0.085  1.00  0.00           N  
HETATM    7  C   UNL     1       4.314  -1.002  -0.425  1.00  0.00           C  
HETATM    8  N   UNL     1      -6.538   1.315  -0.366  1.00  0.00           N1+
HETATM    9  C   UNL     1       4.874  -1.103  -1.640  1.00  0.00           C  
HETATM   10  C   UNL     1       6.002   0.540  -0.604  1.00  0.00           C  
HETATM   11  C   UNL     1       6.845   1.571  -0.202  1.00  0.00           C  
HETATM   12  C   UNL     1       6.709   2.115   1.056  1.00  0.00           C  
HETATM   13  C   UNL     1       3.171  -1.829   0.107  1.00  0.00           C  
HETATM   14  C   UNL     1       1.874  -1.093  -0.111  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.614  -1.491   0.469  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.884  -0.771   0.255  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.883   0.483  -0.361  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.072   1.154  -0.559  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.266   0.589  -0.149  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.277  -0.656   0.464  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.090  -1.342   0.663  1.00  0.00           C  
HETATM   22  O   UNL     1       1.877  -0.004  -0.646  1.00  0.00           O  
HETATM   23  O   UNL     1      -6.454  -1.206   0.865  1.00  0.00           O  
HETATM   24  O   UNL     1      -6.531   2.408  -0.903  1.00  0.00           O  
HETATM   25  O   UNL     1      -7.591   0.820  -0.006  1.00  0.00           O1-
HETATM   26  H   UNL     1       5.655   2.072   2.918  1.00  0.00           H  
HETATM   27  H   UNL     1       6.436  -0.073  -2.555  1.00  0.00           H  
HETATM   28  H   UNL     1       4.157   0.262   2.246  1.00  0.00           H  
HETATM   29  H   UNL     1       0.709  -2.514   0.716  1.00  0.00           H  
HETATM   30  H   UNL     1       4.571  -1.802  -2.406  1.00  0.00           H  
HETATM   31  H   UNL     1       7.598   1.950  -0.877  1.00  0.00           H  
HETATM   32  H   UNL     1       7.365   2.915   1.367  1.00  0.00           H  
HETATM   33  H   UNL     1       3.139  -2.784  -0.416  1.00  0.00           H  
HETATM   34  H   UNL     1       3.315  -2.003   1.174  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.617  -2.460   0.946  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.952   0.928  -0.682  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.071   2.123  -1.036  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.098  -2.313   1.135  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.882  -1.753   0.192  1.00  0.00           H  
CONECT    1   12    3    3   26                                       
CONECT    2   10    9   27                                            
CONECT    3    1    1    5   28                                       
CONECT    4   14    6   29                                            
CONECT    5   10   10    3    7                                       
CONECT    6    4   15   15                                            
CONECT    7    5    9    9   13                                       
CONECT    8   19   24   24   25                                       
CONECT    9    2    7    7   30                                       
CONECT   10   11    2    5    5                                       
CONECT   11   12   12   10   31                                       
CONECT   12   11   11    1   32                                       
CONECT   13    7   14   33   34                                       
CONECT   14   22   22   13    4                                       
CONECT   15    6    6   16   35                                       
CONECT   16   15   21   21   17                                       
CONECT   17   16   18   18   36                                       
CONECT   18   17   17   19   37                                       
CONECT   19   20   20   18    8                                       
CONECT   20   21   23   19   19                                       
CONECT   21   16   16   20   38                                       
CONECT   22   14   14                                                 
CONECT   23   20   39                                                 
CONECT   24    8    8                                                 
CONECT   25    8                                                      
CONECT   26    1                                                      
CONECT   27    2                                                      
CONECT   28    3                                                      
CONECT   29    4                                                      
CONECT   30    9                                                      
CONECT   31   11                                                      
CONECT   32   12                                                      
CONECT   33   13                                                      
CONECT   34   13                                                      
CONECT   35   15                                                      
CONECT   36   17                                                      
CONECT   37   18                                                      
CONECT   38   21                                                      
CONECT   39   23                                                      
MASTER        0    0    0    0    0    0    0    0   39    0   39    0
END
