COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -7.878   0.633  -0.737  1.00  0.00           N  
HETATM    2  C   UNL     1      -8.173  -0.565  -0.273  1.00  0.00           C  
HETATM    3  C   UNL     1      -9.510  -1.172  -0.609  1.00  0.00           C  
HETATM    4  N   UNL     1      -7.331  -1.246   0.477  1.00  0.00           N  
HETATM    5  C   UNL     1      -6.142  -0.741   0.793  1.00  0.00           C  
HETATM    6  N   UNL     1      -5.258  -1.460   1.582  1.00  0.00           N  
HETATM    7  C   UNL     1      -5.798   0.527   0.317  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.713   1.203  -0.465  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.463   1.140   0.650  1.00  0.00           C  
HETATM   10  N   UNL     1      -3.435   0.580  -0.231  1.00  0.00           N  
HETATM   11  C   UNL     1      -1.189   0.491  -0.905  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.115   0.996  -0.111  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.740   2.025   0.924  1.00  0.00           C  
HETATM   14  C   UNL     1       0.218   1.030  -0.859  1.00  0.00           C  
HETATM   15  C   UNL     1       1.196  -0.120  -0.609  1.00  0.00           C  
HETATM   16  O   UNL     1       2.530   0.391  -0.566  1.00  0.00           O  
HETATM   17  P   UNL     1       3.819  -0.542  -0.320  1.00  0.00           P  
HETATM   18  O   UNL     1       3.640  -1.309   0.933  1.00  0.00           O  
HETATM   19  O   UNL     1       3.986  -1.563  -1.554  1.00  0.00           O  
HETATM   20  O   UNL     1       5.134   0.379  -0.203  1.00  0.00           O  
HETATM   21  P   UNL     1       6.633   0.126   0.327  1.00  0.00           P  
HETATM   22  O   UNL     1       6.590  -0.713   1.546  1.00  0.00           O  
HETATM   23  O   UNL     1       7.485  -0.627  -0.813  1.00  0.00           O  
HETATM   24  O   UNL     1       7.326   1.538   0.671  1.00  0.00           O  
HETATM   25  H   UNL     1      -9.427  -1.745  -1.533  1.00  0.00           H  
HETATM   26  H   UNL     1      -9.824  -1.831   0.200  1.00  0.00           H  
HETATM   27  H   UNL     1     -10.247  -0.379  -0.738  1.00  0.00           H  
HETATM   28  H   UNL     1      -5.505  -2.339   1.908  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.393  -1.084   1.808  1.00  0.00           H  
HETATM   30  H   UNL     1      -6.482   2.185  -0.851  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.513   2.220   0.508  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.210   0.922   1.688  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.676  -0.083  -0.897  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.439  -0.308  -1.587  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.611   2.257   1.537  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.945   1.631   1.557  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.394   2.931   0.427  1.00  0.00           H  
HETATM   38  H   UNL     1       0.455   1.508  -1.810  1.00  0.00           H  
HETATM   39  H   UNL     1       0.301   1.760  -0.054  1.00  0.00           H  
HETATM   40  H   UNL     1       0.959  -0.598   0.341  1.00  0.00           H  
HETATM   41  H   UNL     1       1.112  -0.850  -1.414  1.00  0.00           H  
HETATM   42  H   UNL     1       4.107  -1.129  -2.409  1.00  0.00           H  
HETATM   43  H   UNL     1       7.555  -0.133  -1.642  1.00  0.00           H  
HETATM   44  H   UNL     1       8.233   1.462   0.997  1.00  0.00           H  
CONECT    1    2    2    8                                            
CONECT    2    1    1    3    4                                       
CONECT    3    2   25   26   27                                       
CONECT    4    2    5    5                                            
CONECT    5    4    4    6    7                                       
CONECT    6    5   28   29                                            
CONECT    7    5    8    8    9                                       
CONECT    8    1    7    7   30                                       
CONECT    9    7   10   31   32                                       
CONECT   10    9   12   33                                            
CONECT   11   12   12   14   34                                       
CONECT   12   10   11   11   13                                       
CONECT   13   12   35   36   37                                       
CONECT   14   11   15   38   39                                       
CONECT   15   14   16   40   41                                       
CONECT   16   15   17                                                 
CONECT   17   16   18   18   19                                       
CONECT   17   20                                                      
CONECT   18   17   17                                                 
CONECT   19   17   42                                                 
CONECT   20   17   21                                                 
CONECT   21   20   22   22   23                                       
CONECT   21   24                                                      
CONECT   22   21   21                                                 
CONECT   23   21   43                                                 
CONECT   24   21   44                                                 
CONECT   25    3                                                      
CONECT   26    3                                                      
CONECT   27    3                                                      
CONECT   28    6                                                      
CONECT   29    6                                                      
CONECT   30    8                                                      
CONECT   31    9                                                      
CONECT   32    9                                                      
CONECT   33   10                                                      
CONECT   34   11                                                      
CONECT   35   13                                                      
CONECT   36   13                                                      
CONECT   37   13                                                      
CONECT   38   14                                                      
CONECT   39   14                                                      
CONECT   40   15                                                      
CONECT   41   15                                                      
CONECT   42   19                                                      
CONECT   43   23                                                      
CONECT   44   24                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
