COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.266  -0.584   0.608  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.737  -2.448   0.375  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.640  -1.587  -1.564  1.00  0.00           C  
HETATM    4  N   UNL     1      -7.586  -3.336   0.992  1.00  0.00           N  
HETATM    5  N   UNL     1      -6.549  -2.540  -0.910  1.00  0.00           N  
HETATM    6  N   UNL     1      -4.990  -0.576  -0.714  1.00  0.00           N  
HETATM    7  C   UNL     1      -4.070   0.410  -1.285  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.616   1.840  -1.074  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.354   2.685  -0.789  1.00  0.00           C  
HETATM   10  O   UNL     1      -3.194   3.697  -1.785  1.00  0.00           O  
HETATM   11  C   UNL     1      -2.195   1.666  -0.861  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.135   1.990   0.193  1.00  0.00           C  
HETATM   13  O   UNL     1      -0.021   1.110   0.034  1.00  0.00           O  
HETATM   14  P   UNL     1       1.284   1.167   0.976  1.00  0.00           P  
HETATM   15  O   UNL     1       1.846   2.536   0.958  1.00  0.00           O  
HETATM   16  O   UNL     1       0.874   0.775   2.483  1.00  0.00           O  
HETATM   17  O   UNL     1       2.385   0.127   0.432  1.00  0.00           O  
HETATM   18  P   UNL     1       3.957  -0.084   0.707  1.00  0.00           P  
HETATM   19  O   UNL     1       4.157  -0.881   2.092  1.00  0.00           O  
HETATM   20  O   UNL     1       4.624   1.235   0.796  1.00  0.00           O  
HETATM   21  O   UNL     1       4.605  -0.932  -0.498  1.00  0.00           O  
HETATM   22  P   UNL     1       6.114  -1.214  -0.983  1.00  0.00           P  
HETATM   23  O   UNL     1       6.766  -2.366  -0.067  1.00  0.00           O  
HETATM   24  O   UNL     1       6.103  -1.692  -2.520  1.00  0.00           O  
HETATM   25  O   UNL     1       6.912   0.026  -0.858  1.00  0.00           O  
HETATM   26  O   UNL     1      -2.809   0.389  -0.581  1.00  0.00           O  
HETATM   27  O   UNL     1      -4.747   0.242   1.333  1.00  0.00           O  
HETATM   28  N   UNL     1      -6.109  -1.488   1.131  1.00  0.00           N  
HETATM   29  H   UNL     1      -4.856  -2.160  -2.060  1.00  0.00           H  
HETATM   30  H   UNL     1      -6.204  -1.062  -2.335  1.00  0.00           H  
HETATM   31  H   UNL     1      -8.036  -4.019   0.470  1.00  0.00           H  
HETATM   32  H   UNL     1      -7.735  -3.279   1.948  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.915   0.214  -2.346  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.117   2.194  -1.975  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.297   1.867  -0.224  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.410   3.131   0.204  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.924   4.330  -1.824  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.752   1.666  -1.857  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.804   3.021   0.071  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.561   1.861   1.188  1.00  0.00           H  
HETATM   41  H   UNL     1       0.498  -0.111   2.571  1.00  0.00           H  
HETATM   42  H   UNL     1       3.746  -1.755   2.106  1.00  0.00           H  
HETATM   43  H   UNL     1       6.294  -3.209  -0.100  1.00  0.00           H  
HETATM   44  H   UNL     1       6.981  -1.880  -2.880  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.283  -1.462   2.085  1.00  0.00           H  
CONECT    1   27   27    6   28                                       
CONECT    2   28    5    5    4                                       
CONECT    3    6    5   29   30                                       
CONECT    4    2   31   32                                            
CONECT    5    3    2    2                                            
CONECT    6    7    1    3                                            
CONECT    7    8    6   26   33                                       
CONECT    8    9    7   34   35                                       
CONECT    9   10    8   11   36                                       
CONECT   10    9   37                                                 
CONECT   11    9   12   26   38                                       
CONECT   12   13   11   39   40                                       
CONECT   13   14   12                                                 
CONECT   14   15   15   17   13                                       
CONECT   14   16                                                      
CONECT   15   14   14                                                 
CONECT   16   14   41                                                 
CONECT   17   18   14                                                 
CONECT   18   20   20   17   19                                       
CONECT   18   21                                                      
CONECT   19   18   42                                                 
CONECT   20   18   18                                                 
CONECT   21   18   22                                                 
CONECT   22   21   25   25   24                                       
CONECT   22   23                                                      
CONECT   23   22   43                                                 
CONECT   24   22   44                                                 
CONECT   25   22   22                                                 
CONECT   26   11    7                                                 
CONECT   27    1    1                                                 
CONECT   28    1    2   45                                            
CONECT   29    3                                                      
CONECT   30    3                                                      
CONECT   31    4                                                      
CONECT   32    4                                                      
CONECT   33    7                                                      
CONECT   34    8                                                      
CONECT   35    8                                                      
CONECT   36    9                                                      
CONECT   37   10                                                      
CONECT   38   11                                                      
CONECT   39   12                                                      
CONECT   40   12                                                      
CONECT   41   16                                                      
CONECT   42   19                                                      
CONECT   43   23                                                      
CONECT   44   24                                                      
CONECT   45   28                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
