COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.129   0.068   0.383  1.00  0.00           C  
HETATM    2  O   UNL     1      -3.845  -0.008  -0.017  1.00  0.00           O  
HETATM    3  P   UNL     1      -2.915  -1.099   0.715  1.00  0.00           P  
HETATM    4  O   UNL     1      -2.753  -0.710   2.269  1.00  0.00           O  
HETATM    5  O   UNL     1      -3.541  -2.435   0.604  1.00  0.00           O  
HETATM    6  O   UNL     1      -1.465  -1.125   0.015  1.00  0.00           O  
HETATM    7  C   UNL     1      -0.447  -2.062   0.369  1.00  0.00           C  
HETATM    8  C   UNL     1       0.798  -1.810  -0.485  1.00  0.00           C  
HETATM    9  C   UNL     1       1.882  -2.867  -0.180  1.00  0.00           C  
HETATM   10  O   UNL     1       1.861  -3.904  -1.163  1.00  0.00           O  
HETATM   11  C   UNL     1       3.208  -2.077  -0.256  1.00  0.00           C  
HETATM   12  O   UNL     1       4.046  -2.602  -1.287  1.00  0.00           O  
HETATM   13  C   UNL     1       2.767  -0.636  -0.597  1.00  0.00           C  
HETATM   14  O   UNL     1       1.401  -0.546  -0.134  1.00  0.00           O  
HETATM   15  N   UNL     1       3.610   0.335   0.105  1.00  0.00           N  
HETATM   16  C   UNL     1       4.824   0.812  -0.319  1.00  0.00           C  
HETATM   17  C   UNL     1       5.252   1.714   0.671  1.00  0.00           C  
HETATM   18  N   UNL     1       4.295   1.739   1.629  1.00  0.00           N  
HETATM   19  C   UNL     1       3.328   0.935   1.296  1.00  0.00           C  
HETATM   20  N   UNL     1       5.596   0.605  -1.381  1.00  0.00           N  
HETATM   21  C   UNL     1       6.746   1.232  -1.508  1.00  0.00           C  
HETATM   22  N   UNL     1       7.190   2.088  -0.605  1.00  0.00           N  
HETATM   23  C   UNL     1       6.490   2.356   0.492  1.00  0.00           C  
HETATM   24  N   UNL     1       6.963   3.254   1.432  1.00  0.00           N  
HETATM   25  O   UNL     1      -5.537  -0.669   1.259  1.00  0.00           O  
HETATM   26  C   UNL     1      -6.040   1.050  -0.240  1.00  0.00           C  
HETATM   27  C   UNL     1      -5.576   1.894  -1.251  1.00  0.00           C  
HETATM   28  C   UNL     1      -6.434   2.805  -1.832  1.00  0.00           C  
HETATM   29  C   UNL     1      -7.751   2.884  -1.415  1.00  0.00           C  
HETATM   30  C   UNL     1      -8.217   2.050  -0.414  1.00  0.00           C  
HETATM   31  C   UNL     1      -7.371   1.135   0.176  1.00  0.00           C  
HETATM   32  H   UNL     1      -2.348   0.156   2.418  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.194  -1.943   1.423  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.808  -3.076   0.194  1.00  0.00           H  
HETATM   35  H   UNL     1       0.539  -1.826  -1.544  1.00  0.00           H  
HETATM   36  H   UNL     1       1.740  -3.284   0.817  1.00  0.00           H  
HETATM   37  H   UNL     1       2.523  -4.595  -1.020  1.00  0.00           H  
HETATM   38  H   UNL     1       3.723  -2.103   0.704  1.00  0.00           H  
HETATM   39  H   UNL     1       4.303  -3.524  -1.153  1.00  0.00           H  
HETATM   40  H   UNL     1       2.812  -0.471  -1.674  1.00  0.00           H  
HETATM   41  H   UNL     1       2.436   0.763   1.881  1.00  0.00           H  
HETATM   42  H   UNL     1       7.348   1.040  -2.383  1.00  0.00           H  
HETATM   43  H   UNL     1       7.816   3.696   1.295  1.00  0.00           H  
HETATM   44  H   UNL     1       6.443   3.442   2.229  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.548   1.834  -1.577  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.076   3.458  -2.615  1.00  0.00           H  
HETATM   47  H   UNL     1      -8.418   3.599  -1.873  1.00  0.00           H  
HETATM   48  H   UNL     1      -9.246   2.117  -0.093  1.00  0.00           H  
HETATM   49  H   UNL     1      -7.737   0.482   0.954  1.00  0.00           H  
CONECT    1   26   25   25    2                                       
CONECT    2    1    3                                                 
CONECT    3    2    6    5    5                                       
CONECT    3    4                                                      
CONECT    4    3   32                                                 
CONECT    5    3    3                                                 
CONECT    6    7    3                                                 
CONECT    7    8    6   33   34                                       
CONECT    8    9   14    7   35                                       
CONECT    9   11    8   10   36                                       
CONECT   10    9   37                                                 
CONECT   11   13    9   12   38                                       
CONECT   12   11   39                                                 
CONECT   13   15   11   14   40                                       
CONECT   14   13    8                                                 
CONECT   15   16   19   13                                            
CONECT   16   17   17   20   15                                       
CONECT   17   23   18   16   16                                       
CONECT   18   17   19   19                                            
CONECT   19   18   18   15   41                                       
CONECT   20   21   21   16                                            
CONECT   21   22   20   20   42                                       
CONECT   22   23   23   21                                            
CONECT   23   24   22   22   17                                       
CONECT   24   23   43   44                                            
CONECT   25    1    1                                                 
CONECT   26   27   27   31    1                                       
CONECT   27   28   26   26   45                                       
CONECT   28   29   29   27   46                                       
CONECT   29   28   28   30   47                                       
CONECT   30   29   31   31   48                                       
CONECT   31   30   30   26   49                                       
CONECT   32    4                                                      
CONECT   33    7                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36    9                                                      
CONECT   37   10                                                      
CONECT   38   11                                                      
CONECT   39   12                                                      
CONECT   40   13                                                      
CONECT   41   19                                                      
CONECT   42   21                                                      
CONECT   43   24                                                      
CONECT   44   24                                                      
CONECT   45   27                                                      
CONECT   46   28                                                      
CONECT   47   29                                                      
CONECT   48   30                                                      
CONECT   49   31                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
