COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.089  -0.921  -0.267  1.00  0.00           C  
HETATM    2  N   UNL     1      -4.426  -0.248   1.136  1.00  0.00           N  
HETATM    3  O   UNL     1      -1.832  -2.637  -1.812  1.00  0.00           O  
HETATM    4  C   UNL     1       1.088  -0.282   0.799  1.00  0.00           C  
HETATM    5  N   UNL     1      -0.473  -3.157  -0.072  1.00  0.00           N  
HETATM    6  O   UNL     1       0.847  -3.140   1.771  1.00  0.00           O  
HETATM    7  C   UNL     1       1.518   0.698   1.587  1.00  0.00           C  
HETATM    8  N   UNL     1       2.688   1.227   1.157  1.00  0.00           N1+
HETATM    9  C   UNL     1      -2.444  -0.410   0.151  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.298  -1.010   0.995  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.171  -1.093   0.961  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.195  -2.321  -0.830  1.00  0.00           C  
HETATM   13  C   UNL     1       0.145  -2.573   0.962  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.323   0.888   0.366  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.074   0.840  -0.280  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.692   1.875  -1.136  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.531   2.936  -1.334  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.760   2.993  -0.691  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.165   1.973   0.141  1.00  0.00           C  
HETATM   20  C   UNL     1       4.256   0.891  -0.675  1.00  0.00           C  
HETATM   21  C   UNL     1       5.047   1.848  -0.245  1.00  0.00           C  
HETATM   22  C   UNL     1       4.610   2.545   0.990  1.00  0.00           C  
HETATM   23  C   UNL     1       3.498   2.221   1.614  1.00  0.00           C  
HETATM   24  C   UNL     1       3.055   0.636   0.113  1.00  0.00           C  
HETATM   25  C   UNL     1       2.095  -0.406  -0.267  1.00  0.00           C  
HETATM   26  C   UNL     1       2.348  -1.105  -1.338  1.00  0.00           C  
HETATM   27  C   UNL     1       3.554  -0.868  -2.149  1.00  0.00           C  
HETATM   28  C   UNL     1       4.459   0.053  -1.866  1.00  0.00           C  
HETATM   29  H   UNL     1      -0.634  -0.248  -0.995  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.404  -4.106  -0.257  1.00  0.00           H  
HETATM   31  H   UNL     1       0.994   1.034   2.469  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.120  -1.953   1.490  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.695  -0.809   1.873  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.737   1.838  -1.639  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.235   3.736  -1.996  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.412   3.838  -0.858  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.127   2.023   0.631  1.00  0.00           H  
HETATM   38  H   UNL     1       5.960   2.111  -0.760  1.00  0.00           H  
HETATM   39  H   UNL     1       5.223   3.340   1.388  1.00  0.00           H  
HETATM   40  H   UNL     1       3.221   2.756   2.510  1.00  0.00           H  
HETATM   41  H   UNL     1       1.656  -1.878  -1.638  1.00  0.00           H  
HETATM   42  H   UNL     1       3.708  -1.481  -3.025  1.00  0.00           H  
HETATM   43  H   UNL     1       5.327   0.187  -2.495  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.187  -0.477   1.692  1.00  0.00           H  
CONECT    1   11   29    9   12                                       
CONECT    2   14   44   10                                            
CONECT    3   12   12                                                 
CONECT    4   25    7    7   11                                       
CONECT    5   12   13   30                                            
CONECT    6   13   13                                                 
CONECT    7    4    4    8   31                                       
CONECT    8    7   23   24   24                                       
CONECT    9    1   15   10   10                                       
CONECT   10    2    9    9   32                                       
CONECT   11    1    4   33   13                                       
CONECT   12    3    3    5    1                                       
CONECT   13    5    6    6   11                                       
CONECT   14    2   15   15   19                                       
CONECT   15    9   14   14   16                                       
CONECT   16   15   17   17   34                                       
CONECT   17   16   16   35   18                                       
CONECT   18   17   36   19   19                                       
CONECT   19   14   18   18   37                                       
CONECT   20   21   21   24   28                                       
CONECT   21   20   20   22   38                                       
CONECT   22   21   39   23   23                                       
CONECT   23    8   22   22   40                                       
CONECT   24    8    8   20   25                                       
CONECT   25    4   24   26   26                                       
CONECT   26   25   25   27   41                                       
CONECT   27   26   28   28   42                                       
CONECT   28   27   27   20   43                                       
CONECT   29    1                                                      
CONECT   30    5                                                      
CONECT   31    7                                                      
CONECT   32   10                                                      
CONECT   33   11                                                      
CONECT   34   16                                                      
CONECT   35   17                                                      
CONECT   36   18                                                      
CONECT   37   19                                                      
CONECT   38   21                                                      
CONECT   39   22                                                      
CONECT   40   23                                                      
CONECT   41   26                                                      
CONECT   42   27                                                      
CONECT   43   28                                                      
CONECT   44    2                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
