COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -6.710   2.938   0.475  1.00  0.00           O1-
HETATM    2  N   UNL     1      -5.723   2.235   0.356  1.00  0.00           N1+
HETATM    3  O   UNL     1      -4.612   2.719   0.479  1.00  0.00           O  
HETATM    4  C   UNL     1      -5.873   0.791   0.066  1.00  0.00           C  
HETATM    5  C   UNL     1      -7.128   0.241  -0.068  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.746  -0.013  -0.076  1.00  0.00           C  
HETATM    7  N   UNL     1      -3.396   0.238  -0.005  1.00  0.00           N  
HETATM    8  C   UNL     1      -2.712  -0.941  -0.229  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.606  -1.942  -0.441  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.905  -1.385  -0.351  1.00  0.00           C  
HETATM   11  C   UNL     1      -6.193  -1.922  -0.477  1.00  0.00           C  
HETATM   12  C   UNL     1      -7.282  -1.112  -0.340  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.249  -1.089  -0.236  1.00  0.00           C  
HETATM   14  O   UNL     1      -0.749  -2.179  -0.444  1.00  0.00           O  
HETATM   15  N   UNL     1      -0.462  -0.019  -0.011  1.00  0.00           N  
HETATM   16  C   UNL     1       0.922  -0.178   0.091  1.00  0.00           C  
HETATM   17  C   UNL     1       1.771   0.825  -0.361  1.00  0.00           C  
HETATM   18  C   UNL     1       3.136   0.671  -0.261  1.00  0.00           C  
HETATM   19  C   UNL     1       3.668  -0.495   0.295  1.00  0.00           C  
HETATM   20  C   UNL     1       2.811  -1.502   0.749  1.00  0.00           C  
HETATM   21  C   UNL     1       1.446  -1.338   0.651  1.00  0.00           C  
HETATM   22  C   UNL     1       5.128  -0.664   0.403  1.00  0.00           C  
HETATM   23  C   UNL     1       5.699  -1.923   1.004  1.00  0.00           C  
HETATM   24  N   UNL     1       5.922   0.271  -0.019  1.00  0.00           N  
HETATM   25  N   UNL     1       7.310   0.111   0.084  1.00  0.00           N  
HETATM   26  C   UNL     1       8.153   1.103  -0.364  1.00  0.00           C  
HETATM   27  N   UNL     1       9.516   0.945  -0.263  1.00  0.00           N  
HETATM   28  N   UNL     1       7.659   2.192  -0.883  1.00  0.00           N  
HETATM   29  H   UNL     1      -8.001   0.868   0.038  1.00  0.00           H  
HETATM   30  H   UNL     1      -8.274  -1.528  -0.442  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.991   1.102   0.172  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.369  -2.976  -0.643  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.323  -2.974  -0.688  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.857   0.863   0.079  1.00  0.00           H  
HETATM   35  H   UNL     1       1.360   1.727  -0.791  1.00  0.00           H  
HETATM   36  H   UNL     1       0.783  -2.114   1.005  1.00  0.00           H  
HETATM   37  H   UNL     1       3.796   1.451  -0.613  1.00  0.00           H  
HETATM   38  H   UNL     1       3.217  -2.405   1.179  1.00  0.00           H  
HETATM   39  H   UNL     1       5.855  -2.662   0.218  1.00  0.00           H  
HETATM   40  H   UNL     1       6.651  -1.697   1.484  1.00  0.00           H  
HETATM   41  H   UNL     1       5.003  -2.321   1.743  1.00  0.00           H  
HETATM   42  H   UNL     1       9.883   0.135   0.124  1.00  0.00           H  
HETATM   43  H   UNL     1      10.109   1.645  -0.578  1.00  0.00           H  
HETATM   44  H   UNL     1       8.253   2.891  -1.199  1.00  0.00           H  
HETATM   45  H   UNL     1       7.678  -0.700   0.470  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    1    3    3    4                                       
CONECT    3    2    2                                                 
CONECT    4    2    5    6    6                                       
CONECT    5    4   12   12   29                                       
CONECT    6    4    4    7   10                                       
CONECT    7    6    8   31                                            
CONECT    8    7    9    9   13                                       
CONECT    9    8    8   10   32                                       
CONECT   10    6    9   11   11                                       
CONECT   11   10   10   12   33                                       
CONECT   12    5    5   11   30                                       
CONECT   13    8   14   14   15                                       
CONECT   14   13   13                                                 
CONECT   15   13   16   34                                            
CONECT   16   15   17   21   21                                       
CONECT   17   16   18   18   35                                       
CONECT   18   17   17   19   37                                       
CONECT   19   18   20   20   22                                       
CONECT   20   19   19   21   38                                       
CONECT   21   16   16   20   36                                       
CONECT   22   19   23   24   24                                       
CONECT   23   22   39   40   41                                       
CONECT   24   22   22   25                                            
CONECT   25   24   26   45                                            
CONECT   26   25   27   28   28                                       
CONECT   27   26   42   43                                            
CONECT   28   26   26   44                                            
CONECT   29    5                                                      
CONECT   30   12                                                      
CONECT   31    7                                                      
CONECT   32    9                                                      
CONECT   33   11                                                      
CONECT   34   15                                                      
CONECT   35   17                                                      
CONECT   36   21                                                      
CONECT   37   18                                                      
CONECT   38   20                                                      
CONECT   39   23                                                      
CONECT   40   23                                                      
CONECT   41   23                                                      
CONECT   42   27                                                      
CONECT   43   27                                                      
CONECT   44   28                                                      
CONECT   45   25                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
