COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  P   UNL     1      -4.641   0.532   4.833  1.00  0.00           P  
HETATM    2  O   UNL     1      -3.160  -0.078   5.052  1.00  0.00           O  
HETATM    3  O   UNL     1      -5.476   0.603   6.078  1.00  0.00           O  
HETATM    4  O   UNL     1      -5.251  -0.385   3.650  1.00  0.00           O  
HETATM    5  O   UNL     1      -4.367   1.954   4.119  1.00  0.00           O  
HETATM    6  P   UNL     1      -5.360   3.062   3.495  1.00  0.00           P  
HETATM    7  O   UNL     1      -5.898   2.375   2.136  1.00  0.00           O  
HETATM    8  O   UNL     1      -6.429   3.563   4.419  1.00  0.00           O  
HETATM    9  C   UNL     1      -4.231   4.341   2.900  1.00  0.00           C  
HETATM   10  P   UNL     1      -2.920   4.063   1.687  1.00  0.00           P  
HETATM   11  O   UNL     1      -3.696   3.307   0.487  1.00  0.00           O  
HETATM   12  O   UNL     1      -2.184   5.303   1.271  1.00  0.00           O  
HETATM   13  O   UNL     1      -2.015   2.891   2.334  1.00  0.00           O  
HETATM   14  C   UNL     1      -0.881   2.428   1.621  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.199   1.333   2.429  1.00  0.00           C  
HETATM   16  O   UNL     1      -1.128   0.236   2.584  1.00  0.00           O  
HETATM   17  C   UNL     1       1.032   0.761   1.734  1.00  0.00           C  
HETATM   18  O   UNL     1       1.918   0.238   2.725  1.00  0.00           O  
HETATM   19  C   UNL     1       0.447  -0.380   0.926  1.00  0.00           C  
HETATM   20  O   UNL     1       1.399  -1.370   0.596  1.00  0.00           O  
HETATM   21  C   UNL     1      -0.616  -0.910   1.877  1.00  0.00           C  
HETATM   22  N   UNL     1      -1.713  -1.611   1.213  1.00  0.00           N  
HETATM   23  C   UNL     1      -2.843  -1.031   0.688  1.00  0.00           C  
HETATM   24  N   UNL     1      -3.659  -1.916   0.150  1.00  0.00           N  
HETATM   25  C   UNL     1      -3.023  -3.107   0.340  1.00  0.00           C  
HETATM   26  C   UNL     1      -3.448  -4.424  -0.044  1.00  0.00           C  
HETATM   27  O   UNL     1      -4.500  -4.657  -0.626  1.00  0.00           O  
HETATM   28  N   UNL     1      -2.501  -5.385   0.338  1.00  0.00           N  
HETATM   29  C   UNL     1      -1.287  -5.112   1.010  1.00  0.00           C  
HETATM   30  N   UNL     1      -0.510  -6.207   1.286  1.00  0.00           N  
HETATM   31  N   UNL     1      -0.922  -3.895   1.351  1.00  0.00           N  
HETATM   32  C   UNL     1      -1.822  -2.953   0.991  1.00  0.00           C  
HETATM   33  H   UNL     1      -3.751   4.775   3.785  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.865   5.131   2.480  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.208   2.042   0.651  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.199   3.269   1.460  1.00  0.00           H  
HETATM   37  H   UNL     1       0.033   1.713   3.429  1.00  0.00           H  
HETATM   38  H   UNL     1       1.592   1.484   1.136  1.00  0.00           H  
HETATM   39  H   UNL     1       2.578   0.927   2.893  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.005   0.000   0.002  1.00  0.00           H  
HETATM   41  H   UNL     1       2.066  -0.951   0.024  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.213  -1.625   2.603  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.012   0.037   0.729  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.704  -6.355   0.113  1.00  0.00           H  
HETATM   45  H   UNL     1       0.044  -6.196   2.110  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.532  -6.972   0.651  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.059  -0.905   5.571  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.192  -0.272   3.399  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.203   3.080  -0.329  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.563   1.657   2.197  1.00  0.00           H  
CONECT    1    2    3    3    4                                       
CONECT    1    5                                                      
CONECT    2    1   47                                                 
CONECT    3    1    1                                                 
CONECT    4    1   48                                                 
CONECT    5    1    6                                                 
CONECT    6    5    7    8    8                                       
CONECT    6    9                                                      
CONECT    7    6   50                                                 
CONECT    8    6    6                                                 
CONECT    9    6   10   33   34                                       
CONECT   10    9   11   12   12                                       
CONECT   10   13                                                      
CONECT   11   10   49                                                 
CONECT   12   10   10                                                 
CONECT   13   10   14                                                 
CONECT   14   13   15   35   36                                       
CONECT   15   14   16   17   37                                       
CONECT   16   15   21                                                 
CONECT   17   15   18   19   38                                       
CONECT   18   17   39                                                 
CONECT   19   17   20   21   40                                       
CONECT   20   19   41                                                 
CONECT   21   16   19   22   42                                       
CONECT   22   21   23   32                                            
CONECT   23   22   24   24   43                                       
CONECT   24   23   23   25                                            
CONECT   25   24   26   32   32                                       
CONECT   26   25   27   27   28                                       
CONECT   27   26   26                                                 
CONECT   28   26   29   44                                            
CONECT   29   28   30   31   31                                       
CONECT   30   29   45   46                                            
CONECT   31   29   29   32                                            
CONECT   32   22   25   25   31                                       
CONECT   33    9                                                      
CONECT   34    9                                                      
CONECT   35   14                                                      
CONECT   36   14                                                      
CONECT   37   15                                                      
CONECT   38   17                                                      
CONECT   39   18                                                      
CONECT   40   19                                                      
CONECT   41   20                                                      
CONECT   42   21                                                      
CONECT   43   23                                                      
CONECT   44   28                                                      
CONECT   45   30                                                      
CONECT   46   30                                                      
CONECT   47    2                                                      
CONECT   48    4                                                      
CONECT   49   11                                                      
CONECT   50    7                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
