COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.358   1.183   0.039  1.00  0.00           C  
HETATM    2  C   UNL     1       0.259   2.445   0.018  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.756   1.133   0.003  1.00  0.00           C  
HETATM    4  C   UNL     1       0.446  -0.054   0.092  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.539   3.579  -0.032  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.468   2.313  -0.041  1.00  0.00           C  
HETATM    7  O   UNL     1       1.611   2.553   0.046  1.00  0.00           O  
HETATM    8  C   UNL     1      -2.474  -0.193   0.023  1.00  0.00           C  
HETATM    9  N   UNL     1       1.737   0.014   0.119  1.00  0.00           N  
HETATM   10  N   UNL     1      -1.852   3.479  -0.059  1.00  0.00           N  
HETATM   11  C   UNL     1       0.105   4.941  -0.056  1.00  0.00           C  
HETATM   12  O   UNL     1      -3.885   0.030  -0.009  1.00  0.00           O  
HETATM   13  C   UNL     1       2.534  -1.213   0.171  1.00  0.00           C  
HETATM   14  P   UNL     1      -4.585  -1.420   0.014  1.00  0.00           P  
HETATM   15  C   UNL     1       2.235  -2.069  -1.062  1.00  0.00           C  
HETATM   16  C   UNL     1       2.179  -1.999   1.435  1.00  0.00           C  
HETATM   17  P   UNL     1       4.306  -0.786   0.199  1.00  0.00           P  
HETATM   18  O   UNL     1      -4.057  -2.241  -1.098  1.00  0.00           O  
HETATM   19  O   UNL     1      -4.267  -2.147   1.416  1.00  0.00           O  
HETATM   20  O   UNL     1      -6.177  -1.250  -0.153  1.00  0.00           O  
HETATM   21  O   UNL     1       4.674  -0.116   1.616  1.00  0.00           O  
HETATM   22  O   UNL     1       5.183  -2.120  -0.008  1.00  0.00           O  
HETATM   23  O   UNL     1       4.600   0.171  -0.891  1.00  0.00           O  
HETATM   24  C   UNL     1       2.705  -1.333  -2.319  1.00  0.00           C  
HETATM   25  H   UNL     1      -0.045  -1.016   0.107  1.00  0.00           H  
HETATM   26  H   UNL     1      -3.548   2.282  -0.064  1.00  0.00           H  
HETATM   27  H   UNL     1       1.911   2.550  -0.874  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.178  -0.779  -0.846  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.212  -0.734   0.933  1.00  0.00           H  
HETATM   30  H   UNL     1       0.283   5.241  -1.089  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.556   5.664   0.423  1.00  0.00           H  
HETATM   32  H   UNL     1       1.053   4.905   0.481  1.00  0.00           H  
HETATM   33  H   UNL     1       1.162  -2.250  -1.127  1.00  0.00           H  
HETATM   34  H   UNL     1       2.760  -3.020  -0.980  1.00  0.00           H  
HETATM   35  H   UNL     1       2.772  -2.913   1.474  1.00  0.00           H  
HETATM   36  H   UNL     1       2.392  -1.390   2.313  1.00  0.00           H  
HETATM   37  H   UNL     1       1.119  -2.254   1.418  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.627  -1.581   2.112  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.557  -2.139  -0.133  1.00  0.00           H  
HETATM   40  H   UNL     1       4.469  -0.771   2.297  1.00  0.00           H  
HETATM   41  H   UNL     1       6.112  -1.851   0.013  1.00  0.00           H  
HETATM   42  H   UNL     1       3.778  -1.152  -2.254  1.00  0.00           H  
HETATM   43  H   UNL     1       2.492  -1.943  -3.197  1.00  0.00           H  
HETATM   44  H   UNL     1       2.181  -0.382  -2.401  1.00  0.00           H  
CONECT    1    2    2    3    4                                       
CONECT    2    1    1    5    7                                       
CONECT    3    1    6    6    8                                       
CONECT    4    1    9    9   25                                       
CONECT    5    2   10   10   11                                       
CONECT    6    3    3   10   26                                       
CONECT    7    2   27                                                 
CONECT    8    3   12   28   29                                       
CONECT    9    4    4   13                                            
CONECT   10    5    5    6                                            
CONECT   11    5   30   31   32                                       
CONECT   12    8   14                                                 
CONECT   13    9   15   16   17                                       
CONECT   14   12   18   18   19                                       
CONECT   14   20                                                      
CONECT   15   13   24   33   34                                       
CONECT   16   13   35   36   37                                       
CONECT   17   13   21   22   23                                       
CONECT   17   23                                                      
CONECT   18   14   14                                                 
CONECT   19   14   38                                                 
CONECT   20   14   39                                                 
CONECT   21   17   40                                                 
CONECT   22   17   41                                                 
CONECT   23   17   17                                                 
CONECT   24   15   42   43   44                                       
CONECT   25    4                                                      
CONECT   26    6                                                      
CONECT   27    7                                                      
CONECT   28    8                                                      
CONECT   29    8                                                      
CONECT   30   11                                                      
CONECT   31   11                                                      
CONECT   32   11                                                      
CONECT   33   15                                                      
CONECT   34   15                                                      
CONECT   35   16                                                      
CONECT   36   16                                                      
CONECT   37   16                                                      
CONECT   38   19                                                      
CONECT   39   20                                                      
CONECT   40   21                                                      
CONECT   41   22                                                      
CONECT   42   24                                                      
CONECT   43   24                                                      
CONECT   44   24                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
