COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       1.919  -1.998  -0.275  1.00  0.00           N  
HETATM    2  C   UNL     1      -0.995   1.351   0.117  1.00  0.00           C  
HETATM    3  C   UNL     1       0.681  -0.021   0.006  1.00  0.00           C  
HETATM    4  N   UNL     1      -0.378  -2.059  -0.525  1.00  0.00           N  
HETATM    5  C1* UNL     1      -2.941  -0.170  -0.400  1.00  0.00           C  
HETATM    6  O5* UNL     1      -5.803   3.009  -0.857  1.00  0.00           O  
HETATM    7  C   UNL     1       6.505   0.324  -0.268  1.00  0.00           C  
HETATM    8  C   UNL     1       0.798  -2.650  -0.526  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.483  -0.759  -0.267  1.00  0.00           C  
HETATM   10  N   UNL     1      -1.523   0.132  -0.190  1.00  0.00           N  
HETATM   11  C   UNL     1       1.913  -0.697  -0.006  1.00  0.00           C  
HETATM   12  O   UNL     1       7.232   2.112   1.153  1.00  0.00           O  
HETATM   13  C   UNL     1       4.368  -0.744   0.238  1.00  0.00           C  
HETATM   14  O2* UNL     1      -3.402  -2.107   1.036  1.00  0.00           O  
HETATM   15  C   UNL     1       5.490   0.212   0.553  1.00  0.00           C  
HETATM   16  N   UNL     1       0.299   1.259   0.231  1.00  0.00           N  
HETATM   17  C4* UNL     1      -5.062   0.760  -0.374  1.00  0.00           C  
HETATM   18  C5* UNL     1      -5.735   2.020   0.172  1.00  0.00           C  
HETATM   19  C3* UNL     1      -5.080  -0.350   0.695  1.00  0.00           C  
HETATM   20  C2* UNL     1      -3.586  -0.695   0.908  1.00  0.00           C  
HETATM   21  C   UNL     1       7.559   1.372  -0.025  1.00  0.00           C  
HETATM   22  C   UNL     1       6.617  -0.596  -1.457  1.00  0.00           C  
HETATM   23  N   UNL     1       3.093  -0.023   0.256  1.00  0.00           N  
HETATM   24  O3* UNL     1      -5.794  -1.492   0.218  1.00  0.00           O  
HETATM   25  O4* UNL     1      -3.685   1.035  -0.681  1.00  0.00           O  
HETATM   26  H   UNL     1      -1.565   2.259   0.245  1.00  0.00           H  
HETATM   27  H1* UNL     1      -3.063  -0.894  -1.205  1.00  0.00           H  
HETATM   28  H5* UNL     1      -6.219   3.837  -0.581  1.00  0.00           H  
HETATM   29  H   UNL     1       0.848  -3.707  -0.740  1.00  0.00           H  
HETATM   30  H   UNL     1       7.869   2.806   1.372  1.00  0.00           H  
HETATM   31  H   UNL     1       4.527  -1.178  -0.749  1.00  0.00           H  
HETATM   32  H   UNL     1       4.347  -1.538   0.985  1.00  0.00           H  
HETATM   33  H2* UNL     1      -3.789  -2.482   1.839  1.00  0.00           H  
HETATM   34  H   UNL     1       5.458   0.804   1.455  1.00  0.00           H  
HETATM   35  H4* UNL     1      -5.580   0.419  -1.271  1.00  0.00           H  
HETATM   36 H5*1 UNL     1      -5.155   2.407   1.010  1.00  0.00           H  
HETATM   37 H5*2 UNL     1      -6.742   1.777   0.510  1.00  0.00           H  
HETATM   38  H3* UNL     1      -5.522   0.019   1.620  1.00  0.00           H  
HETATM   39  H2* UNL     1      -3.186  -0.172   1.777  1.00  0.00           H  
HETATM   40  H   UNL     1       8.528   0.890   0.106  1.00  0.00           H  
HETATM   41  H   UNL     1       7.602   2.049  -0.878  1.00  0.00           H  
HETATM   42  H   UNL     1       6.036  -0.191  -2.286  1.00  0.00           H  
HETATM   43  H   UNL     1       7.663  -0.681  -1.753  1.00  0.00           H  
HETATM   44  H   UNL     1       6.234  -1.581  -1.191  1.00  0.00           H  
HETATM   45  H   UNL     1       3.076   0.927   0.451  1.00  0.00           H  
HETATM   46  H3* UNL     1      -6.723  -1.317   0.012  1.00  0.00           H  
CONECT    1   11   11    8                                            
CONECT    2   16   16   10   26                                       
CONECT    3   16    9    9   11                                       
CONECT    4    9    8    8                                            
CONECT    5   25   10   20   27                                       
CONECT    6   18   28                                                 
CONECT    7   21   22   15   15                                       
CONECT    8    4    4    1   29                                       
CONECT    9   10    3    3    4                                       
CONECT   10    2    5    9                                            
CONECT   11    3   23    1    1                                       
CONECT   12   21   30                                                 
CONECT   13   15   23   31   32                                       
CONECT   14   20   33                                                 
CONECT   15    7    7   13   34                                       
CONECT   16    2    2    3                                            
CONECT   17   18   25   19   35                                       
CONECT   18    6   17   36   37                                       
CONECT   19   17   20   24   38                                       
CONECT   20   19    5   14   39                                       
CONECT   21   12    7   40   41                                       
CONECT   22    7   42   43   44                                       
CONECT   23   11   13   45                                            
CONECT   24   19   46                                                 
CONECT   25   17    5                                                 
CONECT   26    2                                                      
CONECT   27    5                                                      
CONECT   28    6                                                      
CONECT   29    8                                                      
CONECT   30   12                                                      
CONECT   31   13                                                      
CONECT   32   13                                                      
CONECT   33   14                                                      
CONECT   34   15                                                      
CONECT   35   17                                                      
CONECT   36   18                                                      
CONECT   37   18                                                      
CONECT   38   19                                                      
CONECT   39   20                                                      
CONECT   40   21                                                      
CONECT   41   21                                                      
CONECT   42   22                                                      
CONECT   43   22                                                      
CONECT   44   22                                                      
CONECT   45   23                                                      
CONECT   46   24                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
