COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -2.614  -1.787   2.116  1.00  0.00           O  
HETATM    2  C   UNL     1      -2.808  -0.884   1.336  1.00  0.00           C  
HETATM    3  O   UNL     1      -3.582   0.216   1.564  1.00  0.00           O  
HETATM    4  C   UNL     1      -2.226  -0.754  -0.039  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.194   0.793  -0.246  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.535   1.137   0.420  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.800  -1.232  -0.224  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.324  -0.766  -1.589  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.926   0.247  -2.276  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.132   1.003  -1.747  1.00  0.00           C  
HETATM   11  O   UNL     1      -1.994   2.397  -2.034  1.00  0.00           O  
HETATM   12  C   UNL     1      -0.462   0.637  -3.534  1.00  0.00           C  
HETATM   13  C   UNL     1       0.642  -0.017  -4.051  1.00  0.00           C  
HETATM   14  C   UNL     1       1.274  -1.041  -3.329  1.00  0.00           C  
HETATM   15  C   UNL     1       0.805  -1.426  -2.085  1.00  0.00           C  
HETATM   16  O   UNL     1       1.291   0.153  -5.225  1.00  0.00           O  
HETATM   17  C   UNL     1       2.094  -1.033  -5.398  1.00  0.00           C  
HETATM   18  O   UNL     1       2.319  -1.504  -4.053  1.00  0.00           O  
HETATM   19  C   UNL     1       0.076  -0.644   0.850  1.00  0.00           C  
HETATM   20  C   UNL     1       0.312  -1.353   2.013  1.00  0.00           C  
HETATM   21  C   UNL     1       1.119  -0.816   3.004  1.00  0.00           C  
HETATM   22  O   UNL     1       1.351  -1.515   4.147  1.00  0.00           O  
HETATM   23  C   UNL     1       0.636  -2.747   4.030  1.00  0.00           C  
HETATM   24  C   UNL     1       1.687   0.440   2.830  1.00  0.00           C  
HETATM   25  O   UNL     1       2.480   0.971   3.800  1.00  0.00           O  
HETATM   26  C   UNL     1       1.625   1.718   4.668  1.00  0.00           C  
HETATM   27  C   UNL     1       1.452   1.148   1.657  1.00  0.00           C  
HETATM   28  C   UNL     1       0.644   0.603   0.671  1.00  0.00           C  
HETATM   29  O   UNL     1       2.009   2.375   1.480  1.00  0.00           O  
HETATM   30  C   UNL     1       1.581   2.842   0.198  1.00  0.00           C  
HETATM   31  H   UNL     1      -2.880  -1.224  -0.774  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.353   1.262   0.264  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.543   2.173   0.759  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.365   0.948  -0.261  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.766  -2.320  -0.173  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.041   0.620  -2.211  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.959   2.481  -2.996  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.950   1.425  -4.088  1.00  0.00           H  
HETATM   39  H   UNL     1       1.287  -2.217  -1.528  1.00  0.00           H  
HETATM   40  H   UNL     1       1.551  -1.779  -5.978  1.00  0.00           H  
HETATM   41  H   UNL     1       3.040  -0.787  -5.880  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.132  -2.328   2.149  1.00  0.00           H  
HETATM   43  H   UNL     1       0.792  -3.345   4.928  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.427  -2.540   3.912  1.00  0.00           H  
HETATM   45  H   UNL     1       0.998  -3.296   3.160  1.00  0.00           H  
HETATM   46  H   UNL     1       2.218   2.165   5.466  1.00  0.00           H  
HETATM   47  H   UNL     1       1.129   2.505   4.100  1.00  0.00           H  
HETATM   48  H   UNL     1       0.876   1.055   5.100  1.00  0.00           H  
HETATM   49  H   UNL     1       0.457   1.154  -0.238  1.00  0.00           H  
HETATM   50  H   UNL     1       2.005   3.829   0.011  1.00  0.00           H  
HETATM   51  H   UNL     1       1.919   2.149  -0.571  1.00  0.00           H  
HETATM   52  H   UNL     1       0.493   2.905   0.179  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    4                                       
CONECT    3    2    6                                                 
CONECT    4    2    5    7   31                                       
CONECT    5    4    6   10   32                                       
CONECT    6    3    5   33   34                                       
CONECT    7    4    8   19   35                                       
CONECT    8    7    9   15   15                                       
CONECT    9    8   10   12   12                                       
CONECT   10    5    9   11   36                                       
CONECT   11   10   37                                                 
CONECT   12    9    9   13   38                                       
CONECT   13   12   14   14   16                                       
CONECT   14   13   13   15   18                                       
CONECT   15    8    8   14   39                                       
CONECT   16   13   17                                                 
CONECT   17   16   18   40   41                                       
CONECT   18   14   17                                                 
CONECT   19    7   20   28   28                                       
CONECT   20   19   21   21   42                                       
CONECT   21   20   20   22   24                                       
CONECT   22   21   23                                                 
CONECT   23   22   43   44   45                                       
CONECT   24   21   25   27   27                                       
CONECT   25   24   26                                                 
CONECT   26   25   46   47   48                                       
CONECT   27   24   24   28   29                                       
CONECT   28   19   19   27   49                                       
CONECT   29   27   30                                                 
CONECT   30   29   50   51   52                                       
CONECT   31    4                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    6                                                      
CONECT   35    7                                                      
CONECT   36   10                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   15                                                      
CONECT   40   17                                                      
CONECT   41   17                                                      
CONECT   42   20                                                      
CONECT   43   23                                                      
CONECT   44   23                                                      
CONECT   45   23                                                      
CONECT   46   26                                                      
CONECT   47   26                                                      
CONECT   48   26                                                      
CONECT   49   28                                                      
CONECT   50   30                                                      
CONECT   51   30                                                      
CONECT   52   30                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
