COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -6.044   1.051   0.196  1.00  0.00           O  
HETATM    2  P   UNL     1      -4.527   1.494  -0.113  1.00  0.00           P  
HETATM    3  O   UNL     1      -4.440   2.105  -1.600  1.00  0.00           O  
HETATM    4  O   UNL     1      -4.103   2.519   0.867  1.00  0.00           O  
HETATM    5  O   UNL     1      -3.560   0.212  -0.003  1.00  0.00           O  
HETATM    6  C   UNL     1      -2.138   0.298  -0.120  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.538  -1.076   0.031  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.346  -2.172   0.247  1.00  0.00           C  
HETATM    9  N   UNL     1      -1.834  -3.381   0.382  1.00  0.00           N  
HETATM   10  C   UNL     1      -0.537  -3.603   0.317  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.014  -5.007   0.479  1.00  0.00           C  
HETATM   12  C   UNL     1       0.353  -2.560   0.102  1.00  0.00           C  
HETATM   13  O   UNL     1       1.688  -2.794   0.036  1.00  0.00           O  
HETATM   14  C   UNL     1      -0.152  -1.259  -0.051  1.00  0.00           C  
HETATM   15  C   UNL     1       0.752  -0.115  -0.282  1.00  0.00           C  
HETATM   16  N   UNL     1       2.030  -0.304  -0.345  1.00  0.00           N  
HETATM   17  CA  UNL     1       2.927   0.831  -0.575  1.00  0.00           C  
HETATM   18  C   UNL     1       3.708   0.606  -1.844  1.00  0.00           C  
HETATM   19  O   UNL     1       3.900  -0.518  -2.243  1.00  0.00           O  
HETATM   20  OXT UNL     1       4.189   1.654  -2.530  1.00  0.00           O  
HETATM   21  C   UNL     1       3.895   0.962   0.603  1.00  0.00           C  
HETATM   22  O   UNL     1       4.758   2.081   0.389  1.00  0.00           O  
HETATM   23  C   UNL     1       3.102   1.169   1.895  1.00  0.00           C  
HETATM   24  C   UNL     1       4.062   1.185   3.086  1.00  0.00           C  
HETATM   25  C   UNL     1       2.353   2.502   1.825  1.00  0.00           C  
HETATM   26  H   UNL     1      -6.683   1.774   0.147  1.00  0.00           H  
HETATM   27  H   UNL     1      -4.704   1.488  -2.296  1.00  0.00           H  
HETATM   28  H   UNL     1      -1.878   0.702  -1.099  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.748   0.953   0.659  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.417  -2.040   0.308  1.00  0.00           H  
HETATM   31  H   UNL     1       0.037  -5.490  -0.497  1.00  0.00           H  
HETATM   32  H   UNL     1       0.982  -4.975   0.921  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.682  -5.571   1.129  1.00  0.00           H  
HETATM   34  H   UNL     1       2.010  -2.987  -0.856  1.00  0.00           H  
HETATM   35  H   UNL     1       0.346   0.879  -0.398  1.00  0.00           H  
HETATM   36  HA  UNL     1       2.341   1.745  -0.666  1.00  0.00           H  
HETATM   37  HXT UNL     1       4.621   1.465  -3.375  1.00  0.00           H  
HETATM   38  H   UNL     1       4.492   0.053   0.685  1.00  0.00           H  
HETATM   39  H   UNL     1       4.293   2.925   0.306  1.00  0.00           H  
HETATM   40  H   UNL     1       2.386   0.356   2.016  1.00  0.00           H  
HETATM   41  H   UNL     1       4.778   1.998   2.965  1.00  0.00           H  
HETATM   42  H   UNL     1       3.496   1.333   4.006  1.00  0.00           H  
HETATM   43  H   UNL     1       4.595   0.236   3.136  1.00  0.00           H  
HETATM   44  H   UNL     1       1.672   2.492   0.974  1.00  0.00           H  
HETATM   45  H   UNL     1       1.784   2.648   2.743  1.00  0.00           H  
HETATM   46  H   UNL     1       3.069   3.315   1.708  1.00  0.00           H  
CONECT    1    2   26                                                 
CONECT    2    4    4    5    1                                       
CONECT    2    3                                                      
CONECT    3    2   27                                                 
CONECT    4    2    2                                                 
CONECT    5    6    2                                                 
CONECT    6    7    5   28   29                                       
CONECT    7    8    8   14    6                                       
CONECT    8    9    7    7   30                                       
CONECT    9   10   10    8                                            
CONECT   10   11    9    9   12                                       
CONECT   11   10   31   32   33                                       
CONECT   12   10   13   14   14                                       
CONECT   13   12   34                                                 
CONECT   14   12   12    7   15                                       
CONECT   15   14   16   16   35                                       
CONECT   16   15   15   17                                            
CONECT   17   18   16   21   36                                       
CONECT   18   19   19   20   17                                       
CONECT   19   18   18                                                 
CONECT   20   18   37                                                 
CONECT   21   17   22   23   38                                       
CONECT   22   21   39                                                 
CONECT   23   21   25   24   40                                       
CONECT   24   23   41   42   43                                       
CONECT   25   23   44   45   46                                       
CONECT   26    1                                                      
CONECT   27    3                                                      
CONECT   28    6                                                      
CONECT   29    6                                                      
CONECT   30    8                                                      
CONECT   31   11                                                      
CONECT   32   11                                                      
CONECT   33   11                                                      
CONECT   34   13                                                      
CONECT   35   15                                                      
CONECT   36   17                                                      
CONECT   37   20                                                      
CONECT   38   21                                                      
CONECT   39   22                                                      
CONECT   40   23                                                      
CONECT   41   24                                                      
CONECT   42   24                                                      
CONECT   43   24                                                      
CONECT   44   25                                                      
CONECT   45   25                                                      
CONECT   46   25                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
