COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -4.020  -3.657   0.538  1.00  0.00           O  
HETATM    2  C   UNL     1      -3.061  -2.973   0.233  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.195  -3.351  -0.896  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.183  -2.570  -1.241  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.846  -1.290  -0.557  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.019  -0.157  -1.570  1.00  0.00           C  
HETATM    7  C   UNL     1       0.623  -1.281  -0.122  1.00  0.00           C  
HETATM    8  C   UNL     1       1.510  -1.512  -1.341  1.00  0.00           C  
HETATM    9  C   UNL     1       3.001  -1.384  -0.990  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.744  -1.747   0.981  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.718  -0.986   0.625  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.399   0.248   1.448  1.00  0.00           C  
HETATM   13  O   UNL     1      -1.663   1.423   0.678  1.00  0.00           O  
HETATM   14  C   UNL     1      -2.996   1.919   0.812  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.157   3.123  -0.019  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.286   4.084  -0.682  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.447   5.288  -1.512  1.00  0.00           C  
HETATM   18  C   UNL     1       0.085   0.200   1.826  1.00  0.00           C  
HETATM   19  C   UNL     1       0.933   0.061   0.561  1.00  0.00           C  
HETATM   20  C   UNL     1       2.407   0.057   0.926  1.00  0.00           C  
HETATM   21  C   UNL     1       3.206  -0.002  -0.403  1.00  0.00           C  
HETATM   22  C   UNL     1       2.671   1.054  -1.373  1.00  0.00           C  
HETATM   23  C   UNL     1       2.941   1.359   1.537  1.00  0.00           C  
HETATM   24  C   UNL     1       4.458   1.286   1.212  1.00  0.00           C  
HETATM   25  C   UNL     1       4.602   0.361   0.008  1.00  0.00           C  
HETATM   26  O   UNL     1       5.631  -0.006  -0.508  1.00  0.00           O  
HETATM   27  H   UNL     1      -2.385  -4.264  -1.442  1.00  0.00           H  
HETATM   28  H   UNL     1      -0.564  -2.880  -2.070  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.051  -0.138  -1.920  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.779   0.794  -1.096  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.352  -0.321  -2.416  1.00  0.00           H  
HETATM   32  H   UNL     1       0.792  -2.091   0.587  1.00  0.00           H  
HETATM   33  H   UNL     1       1.322  -2.512  -1.733  1.00  0.00           H  
HETATM   34  H   UNL     1       1.262  -0.777  -2.107  1.00  0.00           H  
HETATM   35  H   UNL     1       3.277  -2.143  -0.258  1.00  0.00           H  
HETATM   36  H   UNL     1       3.606  -1.499  -1.890  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.349  -1.466   1.831  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.010   0.256   2.351  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.702   1.155   0.486  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.187   2.169   1.855  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.464   5.667  -1.410  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.741   6.052  -1.186  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.256   5.038  -2.556  1.00  0.00           H  
HETATM   44  H   UNL     1       0.356   1.118   2.346  1.00  0.00           H  
HETATM   45  H   UNL     1       0.265  -0.654   2.479  1.00  0.00           H  
HETATM   46  H   UNL     1       0.712   0.881  -0.123  1.00  0.00           H  
HETATM   47  H   UNL     1       2.638  -0.791   1.571  1.00  0.00           H  
HETATM   48  H   UNL     1       1.626   0.843  -1.600  1.00  0.00           H  
HETATM   49  H   UNL     1       2.751   2.041  -0.916  1.00  0.00           H  
HETATM   50  H   UNL     1       3.255   1.031  -2.293  1.00  0.00           H  
HETATM   51  H   UNL     1       2.484   2.226   1.060  1.00  0.00           H  
HETATM   52  H   UNL     1       2.774   1.379   2.614  1.00  0.00           H  
HETATM   53  H   UNL     1       4.835   2.279   0.966  1.00  0.00           H  
HETATM   54  H   UNL     1       5.003   0.880   2.063  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    3    1    1   10                                       
CONECT    3    4    4    2   27                                       
CONECT    4    5    3    3   28                                       
CONECT    5    4    6    7   11                                       
CONECT    6    5   29   30   31                                       
CONECT    7    8    5   19   32                                       
CONECT    8    9    7   33   34                                       
CONECT    9    8   21   35   36                                       
CONECT   10    2   11   11   37                                       
CONECT   11    5   10   10   12                                       
CONECT   12   11   18   13   38                                       
CONECT   13   12   14                                                 
CONECT   14   13   15   39   40                                       
CONECT   15   14   16   16   16                                       
CONECT   16   15   15   15   17                                       
CONECT   17   16   41   42   43                                       
CONECT   18   19   12   44   45                                       
CONECT   19    7   20   18   46                                       
CONECT   20   21   19   23   47                                       
CONECT   21    9   22   25   20                                       
CONECT   22   21   48   49   50                                       
CONECT   23   24   20   51   52                                       
CONECT   24   25   23   53   54                                       
CONECT   25   26   26   21   24                                       
CONECT   26   25   25                                                 
CONECT   27    3                                                      
CONECT   28    4                                                      
CONECT   29    6                                                      
CONECT   30    6                                                      
CONECT   31    6                                                      
CONECT   32    7                                                      
CONECT   33    8                                                      
CONECT   34    8                                                      
CONECT   35    9                                                      
CONECT   36    9                                                      
CONECT   37   10                                                      
CONECT   38   12                                                      
CONECT   39   14                                                      
CONECT   40   14                                                      
CONECT   41   17                                                      
CONECT   42   17                                                      
CONECT   43   17                                                      
CONECT   44   18                                                      
CONECT   45   18                                                      
CONECT   46   19                                                      
CONECT   47   20                                                      
CONECT   48   22                                                      
CONECT   49   22                                                      
CONECT   50   22                                                      
CONECT   51   23                                                      
CONECT   52   23                                                      
CONECT   53   24                                                      
CONECT   54   24                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
