COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       3.710   2.173   2.066  1.00  0.00           O  
HETATM    2  C   UNL     1       3.582   1.773   0.700  1.00  0.00           C  
HETATM    3  C   UNL     1       4.172   0.370   0.520  1.00  0.00           C  
HETATM    4  O   UNL     1       5.570   0.399   0.811  1.00  0.00           O  
HETATM    5  C   UNL     1       3.959  -0.079  -0.929  1.00  0.00           C  
HETATM    6  O   UNL     1       4.440  -1.414  -1.091  1.00  0.00           O  
HETATM    7  C   UNL     1       2.464  -0.031  -1.256  1.00  0.00           C  
HETATM    8  C   UNL     1       2.249  -0.420  -2.720  1.00  0.00           C  
HETATM    9  O   UNL     1       0.848  -0.489  -2.993  1.00  0.00           O  
HETATM   10  O   UNL     1       1.972   1.293  -1.038  1.00  0.00           O  
HETATM   11  C   UNL     1       2.102   1.751   0.310  1.00  0.00           C  
HETATM   12  O   UNL     1       1.392   0.868   1.181  1.00  0.00           O  
HETATM   13  C   UNL     1       0.044   0.812   1.038  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.562   1.564   0.111  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.034   1.477   0.002  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.708   1.946  -1.125  1.00  0.00           C  
HETATM   17  O   UNL     1      -2.017   2.498  -2.157  1.00  0.00           O  
HETATM   18  C   UNL     1      -4.090   1.844  -1.186  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.794   1.280  -0.132  1.00  0.00           C  
HETATM   20  O   UNL     1      -6.148   1.185  -0.200  1.00  0.00           O  
HETATM   21  C   UNL     1      -0.771  -0.100   1.916  1.00  0.00           C  
HETATM   22  O   UNL     1      -2.067   0.453   2.148  1.00  0.00           O  
HETATM   23  C   UNL     1      -2.750   0.908   1.065  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.126   0.812   0.992  1.00  0.00           C  
HETATM   25  C   UNL     1      -0.916  -1.440   1.243  1.00  0.00           C  
HETATM   26  C   UNL     1      -0.108  -2.495   1.623  1.00  0.00           C  
HETATM   27  C   UNL     1      -0.239  -3.724   1.007  1.00  0.00           C  
HETATM   28  C   UNL     1      -1.183  -3.900   0.005  1.00  0.00           C  
HETATM   29  O   UNL     1      -1.314  -5.108  -0.603  1.00  0.00           O  
HETATM   30  C   UNL     1      -1.993  -2.839  -0.375  1.00  0.00           C  
HETATM   31  C   UNL     1      -1.861  -1.614   0.249  1.00  0.00           C  
HETATM   32  H   UNL     1       3.355   3.052   2.253  1.00  0.00           H  
HETATM   33  H   UNL     1       4.116   2.477   0.062  1.00  0.00           H  
HETATM   34  H   UNL     1       3.673  -0.324   1.195  1.00  0.00           H  
HETATM   35  H   UNL     1       5.779   0.682   1.712  1.00  0.00           H  
HETATM   36  H   UNL     1       4.500   0.588  -1.600  1.00  0.00           H  
HETATM   37  H   UNL     1       5.381  -1.520  -0.895  1.00  0.00           H  
HETATM   38  H   UNL     1       1.929  -0.728  -0.612  1.00  0.00           H  
HETATM   39  H   UNL     1       2.709   0.327  -3.366  1.00  0.00           H  
HETATM   40  H   UNL     1       2.704  -1.393  -2.907  1.00  0.00           H  
HETATM   41  H   UNL     1       0.637  -0.731  -3.905  1.00  0.00           H  
HETATM   42  H   UNL     1       1.688   2.756   0.395  1.00  0.00           H  
HETATM   43  H   UNL     1       0.007   2.214  -0.537  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.742   1.861  -2.831  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.619   2.205  -2.055  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.466   0.362  -0.595  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.681   0.370   1.807  1.00  0.00           H  
HETATM   48  H   UNL     1       0.627  -2.358   2.403  1.00  0.00           H  
HETATM   49  H   UNL     1       0.393  -4.548   1.304  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.949  -5.697  -0.174  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.728  -2.973  -1.154  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.492  -0.788  -0.046  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.259  -0.231   2.870  1.00  0.00           H  
CONECT    1    2   32                                                 
CONECT    2    1   11    3   33                                       
CONECT    3    2    4    5   34                                       
CONECT    4    3   35                                                 
CONECT    5    3    6    7   36                                       
CONECT    6    5   37                                                 
CONECT    7    5   10    8   38                                       
CONECT    8    7    9   39   40                                       
CONECT    9    8   41                                                 
CONECT   10   11    7                                                 
CONECT   11   12    2   10   42                                       
CONECT   12   13   11                                                 
CONECT   13   21   12   14   14                                       
CONECT   14   13   13   15   43                                       
CONECT   15   23   14   16   16                                       
CONECT   16   15   15   18   17                                       
CONECT   17   16   44                                                 
CONECT   18   19   19   16   45                                       
CONECT   19   24   20   18   18                                       
CONECT   20   19   46                                                 
CONECT   21   25   22   13   53                                       
CONECT   22   21   23                                                 
CONECT   23   22   24   24   15                                       
CONECT   24   23   23   19   47                                       
CONECT   25   26   26   31   21                                       
CONECT   26   27   25   25   48                                       
CONECT   27   28   28   26   49                                       
CONECT   28   29   27   27   30                                       
CONECT   29   28   50                                                 
CONECT   30   28   31   31   51                                       
CONECT   31   30   30   25   52                                       
CONECT   32    1                                                      
CONECT   33    2                                                      
CONECT   34    3                                                      
CONECT   35    4                                                      
CONECT   36    5                                                      
CONECT   37    6                                                      
CONECT   38    7                                                      
CONECT   39    8                                                      
CONECT   40    8                                                      
CONECT   41    9                                                      
CONECT   42   11                                                      
CONECT   43   14                                                      
CONECT   44   17                                                      
CONECT   45   18                                                      
CONECT   46   20                                                      
CONECT   47   24                                                      
CONECT   48   26                                                      
CONECT   49   27                                                      
CONECT   50   29                                                      
CONECT   51   30                                                      
CONECT   52   31                                                      
CONECT   53   21                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
