COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.165   4.398   0.561  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.164  -2.861   1.749  1.00  0.00           C  
HETATM    3  O   UNL     1       4.361  -3.589  -0.425  1.00  0.00           O  
HETATM    4  O   UNL     1      -6.364   1.634  -0.115  1.00  0.00           O  
HETATM    5  C   UNL     1       2.404  -3.255   0.885  1.00  0.00           C  
HETATM    6  C   UNL     1       2.492  -2.486  -1.396  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.245   1.494   0.956  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.631   0.365  -1.135  1.00  0.00           C  
HETATM    9  C   UNL     1       1.293   2.303  -1.332  1.00  0.00           C  
HETATM   10  C   UNL     1       1.969   1.664   0.888  1.00  0.00           C  
HETATM   11  C   UNL     1       1.119  -2.774   1.004  1.00  0.00           C  
HETATM   12  C   UNL     1       1.207  -2.001  -1.288  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.950   1.022   0.976  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.337  -0.111  -1.122  1.00  0.00           C  
HETATM   15  C   UNL     1       0.235   1.422  -1.268  1.00  0.00           C  
HETATM   16  C   UNL     1       0.913   0.781   0.960  1.00  0.00           C  
HETATM   17  C   UNL     1       4.058   3.374   0.820  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.010  -2.580   0.253  1.00  0.00           C  
HETATM   19  O   UNL     1       3.204   3.297  -0.322  1.00  0.00           O  
HETATM   20  C   UNL     1      -0.864  -1.626   0.037  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.097  -0.293  -0.047  1.00  0.00           C  
HETATM   22  C   UNL     1       3.094  -3.113  -0.313  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.089   1.167  -0.098  1.00  0.00           C  
HETATM   24  C   UNL     1       2.162   2.427  -0.256  1.00  0.00           C  
HETATM   25  C   UNL     1       0.508  -2.141  -0.084  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.487   0.215  -0.064  1.00  0.00           C  
HETATM   27  C   UNL     1       0.038   0.654  -0.119  1.00  0.00           C  
HETATM   28  H   UNL     1       5.817   4.457   1.432  1.00  0.00           H  
HETATM   29  H   UNL     1       5.747   4.092  -0.308  1.00  0.00           H  
HETATM   30  H   UNL     1       4.720   5.375   0.373  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.064  -3.453   1.917  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.294  -3.413   2.106  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.243  -1.918   2.290  1.00  0.00           H  
HETATM   34  H   UNL     1       4.412  -4.505  -0.732  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.465   2.488  -0.557  1.00  0.00           H  
HETATM   36  H   UNL     1       2.879  -3.740   1.725  1.00  0.00           H  
HETATM   37  H   UNL     1       3.032  -2.378  -2.325  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.606   2.114   1.763  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.290   0.113  -1.953  1.00  0.00           H  
HETATM   40  H   UNL     1       1.449   2.895  -2.222  1.00  0.00           H  
HETATM   41  H   UNL     1       2.647   1.763   1.723  1.00  0.00           H  
HETATM   42  H   UNL     1       0.584  -2.885   1.935  1.00  0.00           H  
HETATM   43  H   UNL     1       0.740  -1.513  -2.131  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.295   1.277   1.796  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.982  -0.734  -1.929  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.440   1.327  -2.105  1.00  0.00           H  
HETATM   47  H   UNL     1       0.764   0.187   1.850  1.00  0.00           H  
HETATM   48  H   UNL     1       4.504   2.397   1.007  1.00  0.00           H  
HETATM   49  H   UNL     1       3.477   3.681   1.689  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.811  -3.513  -0.273  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.929  -2.136  -0.129  1.00  0.00           H  
CONECT    1   17   28   29   30                                       
CONECT    2   18   31   32   33                                       
CONECT    3   22   34                                                 
CONECT    4   23   35                                                 
CONECT    5   11   11   22   36                                       
CONECT    6   12   22   22   37                                       
CONECT    7   13   13   23   38                                       
CONECT    8   14   23   23   39                                       
CONECT    9   15   15   24   40                                       
CONECT   10   16   24   24   41                                       
CONECT   11    5    5   25   42                                       
CONECT   12    6   25   25   43                                       
CONECT   13    7    7   26   44                                       
CONECT   14    8   26   26   45                                       
CONECT   15    9    9   27   46                                       
CONECT   16   10   27   27   47                                       
CONECT   17    1   19   48   49                                       
CONECT   18    2   20   50   51                                       
CONECT   19   17   24                                                 
CONECT   20   18   21   21   25                                       
CONECT   21   20   20   26   27                                       
CONECT   22    3    5    6    6                                       
CONECT   23    4    7    8    8                                       
CONECT   24    9   10   10   19                                       
CONECT   25   11   12   12   20                                       
CONECT   26   13   14   14   21                                       
CONECT   27   15   16   16   21                                       
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    2                                                      
CONECT   32    2                                                      
CONECT   33    2                                                      
CONECT   34    3                                                      
CONECT   35    4                                                      
CONECT   36    5                                                      
CONECT   37    6                                                      
CONECT   38    7                                                      
CONECT   39    8                                                      
CONECT   40    9                                                      
CONECT   41   10                                                      
CONECT   42   11                                                      
CONECT   43   12                                                      
CONECT   44   13                                                      
CONECT   45   14                                                      
CONECT   46   15                                                      
CONECT   47   16                                                      
CONECT   48   17                                                      
CONECT   49   17                                                      
CONECT   50   18                                                      
CONECT   51   18                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
