COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.417   4.404  -0.310  1.00  0.00           C  
HETATM    2  O   UNL     1      -1.657   1.098   1.807  1.00  0.00           O  
HETATM    3  O   UNL     1       2.544  -3.792   1.331  1.00  0.00           O  
HETATM    4  O   UNL     1      -8.020  -2.441   0.149  1.00  0.00           O  
HETATM    5  O   UNL     1       1.712   3.982   0.389  1.00  0.00           O  
HETATM    6  O   UNL     1       4.510  -4.146  -0.211  1.00  0.00           O  
HETATM    7  O   UNL     1       2.071  -3.855  -1.147  1.00  0.00           O  
HETATM    8  C   UNL     1      -3.834   0.951  -1.500  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.447   1.130  -1.610  1.00  0.00           C  
HETATM   10  C   UNL     1       4.109   0.741  -0.242  1.00  0.00           C  
HETATM   11  C   UNL     1      -7.726  -1.046   0.045  1.00  0.00           C  
HETATM   12  C   UNL     1      -6.213  -0.850  -0.063  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.898   0.643  -0.175  1.00  0.00           C  
HETATM   14  C   UNL     1       0.503   1.411   0.668  1.00  0.00           C  
HETATM   15  C   UNL     1       2.257  -0.882   0.227  1.00  0.00           C  
HETATM   16  N   UNL     1      -0.301   1.359  -0.555  1.00  0.00           N  
HETATM   17  N   UNL     1      -3.655   0.891   0.851  1.00  0.00           N  
HETATM   18  N   UNL     1       4.583   1.966  -0.361  1.00  0.00           N  
HETATM   19  O   UNL     1       3.306  -1.815  -0.040  1.00  0.00           O  
HETATM   20  C   UNL     1       3.826   3.026  -0.162  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.407   0.836  -0.281  1.00  0.00           C  
HETATM   22  C   UNL     1       2.786   0.522   0.094  1.00  0.00           C  
HETATM   23  C   UNL     1       2.489   2.886   0.184  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.688   1.180  -0.474  1.00  0.00           C  
HETATM   25  C   UNL     1       1.953   1.609   0.306  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.319   1.050   0.783  1.00  0.00           C  
HETATM   27  P   UNL     1       3.096  -3.410   0.012  1.00  0.00           P  
HETATM   28  H   UNL     1       4.303   4.740  -1.341  1.00  0.00           H  
HETATM   29  H   UNL     1       3.901   5.095   0.356  1.00  0.00           H  
HETATM   30  H   UNL     1       5.476   4.374  -0.054  1.00  0.00           H  
HETATM   31  H   UNL     1      -8.964  -2.640   0.221  1.00  0.00           H  
HETATM   32  H   UNL     1       1.266   4.302  -0.407  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.445   0.910  -2.390  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.985   1.227  -2.581  1.00  0.00           H  
HETATM   35  H   UNL     1       4.762  -0.102  -0.414  1.00  0.00           H  
HETATM   36  H   UNL     1      -8.210  -0.638  -0.843  1.00  0.00           H  
HETATM   37  H   UNL     1      -8.097  -0.530   0.930  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.729  -1.258   0.825  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.842  -1.367  -0.949  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.381   1.051  -1.062  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.269   1.159   0.711  1.00  0.00           H  
HETATM   42  H   UNL     1       0.167   2.241   1.289  1.00  0.00           H  
HETATM   43  H   UNL     1       0.390   0.477   1.217  1.00  0.00           H  
HETATM   44  H   UNL     1       1.446  -1.034  -0.485  1.00  0.00           H  
HETATM   45  H   UNL     1       1.884  -1.036   1.240  1.00  0.00           H  
HETATM   46  H   UNL     1       0.126   1.447  -1.422  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.084   0.802   1.716  1.00  0.00           H  
HETATM   48  H   UNL     1       4.459  -5.111  -0.192  1.00  0.00           H  
HETATM   49  H   UNL     1       2.369  -3.635  -2.041  1.00  0.00           H  
CONECT    1   28   29   30   20                                       
CONECT    2   26   26                                                 
CONECT    3   27   27                                                 
CONECT    4   31   11                                                 
CONECT    5   23   32                                                 
CONECT    6   27   48                                                 
CONECT    7   27   49                                                 
CONECT    8    9   33   21   21                                       
CONECT    9    8   24   24   34                                       
CONECT   10   18   35   22   22                                       
CONECT   11   12    4   36   37                                       
CONECT   12   11   38   39   13                                       
CONECT   13   21   12   40   41                                       
CONECT   14   25   42   43   16                                       
CONECT   15   22   19   44   45                                       
CONECT   16   14   46   24                                            
CONECT   17   26   47   21                                            
CONECT   18   10   20   20                                            
CONECT   19   15   27                                                 
CONECT   20    1   18   18   23                                       
CONECT   21   13    8    8   17                                       
CONECT   22   15   10   10   25                                       
CONECT   23    5   20   25   25                                       
CONECT   24    9    9   16   26                                       
CONECT   25   14   23   23   22                                       
CONECT   26   17   24    2    2                                       
CONECT   27    6    7   19    3                                       
CONECT   27    3                                                      
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    4                                                      
CONECT   32    5                                                      
CONECT   33    8                                                      
CONECT   34    9                                                      
CONECT   35   10                                                      
CONECT   36   11                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   12                                                      
CONECT   40   13                                                      
CONECT   41   13                                                      
CONECT   42   14                                                      
CONECT   43   14                                                      
CONECT   44   15                                                      
CONECT   45   15                                                      
CONECT   46   16                                                      
CONECT   47   17                                                      
CONECT   48    6                                                      
CONECT   49    7                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
