COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.789   0.822   0.046  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.238   1.231   0.100  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.123   0.008  -0.152  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.594   0.424  -0.097  1.00  0.00           C  
HETATM    5  C   UNL     1      -7.479  -0.799  -0.350  1.00  0.00           C  
HETATM    6  C   UNL     1      -8.951  -0.383  -0.295  1.00  0.00           C  
HETATM    7  C   UNL     1      -9.835  -1.606  -0.547  1.00  0.00           C  
HETATM    8  C   UNL     1       1.481   0.417   1.503  1.00  0.00           C  
HETATM    9  C   UNL     1       0.008   0.832   1.567  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.452   1.271   0.174  1.00  0.00           C  
HETATM   11  C   UNL     1       0.451   2.407  -0.316  1.00  0.00           C  
HETATM   12  C   UNL     1       1.906   1.932  -0.307  1.00  0.00           C  
HETATM   13  O   UNL     1      -0.781  -0.276   2.004  1.00  0.00           O  
HETATM   14  O   UNL     1      -1.826   1.736   0.240  1.00  0.00           O  
HETATM   15  O   UNL     1       0.077   2.775  -1.645  1.00  0.00           O  
HETATM   16  O   UNL     1       2.260   1.509   1.011  1.00  0.00           O  
HETATM   17  C   UNL     1       2.821   3.080  -0.738  1.00  0.00           C  
HETATM   18  O   UNL     1       4.165   2.606  -0.842  1.00  0.00           O  
HETATM   19  C   UNL     1     -11.307  -1.190  -0.492  1.00  0.00           C  
HETATM   20  O   UNL     1      -2.494  -0.331  -0.167  1.00  0.00           O  
HETATM   21  C   UNL     1       3.285  -1.686   2.090  1.00  0.00           C  
HETATM   22  C   UNL     1       2.920  -1.301   0.655  1.00  0.00           C  
HETATM   23  C   UNL     1       2.939  -2.553  -0.244  1.00  0.00           C  
HETATM   24  C   UNL     1       4.053  -2.260  -1.278  1.00  0.00           C  
HETATM   25  C   UNL     1       4.890  -1.174  -0.556  1.00  0.00           C  
HETATM   26  C   UNL     1       5.652  -0.318  -1.569  1.00  0.00           C  
HETATM   27  O   UNL     1       3.464  -0.502   2.870  1.00  0.00           O  
HETATM   28  O   UNL     1       1.623  -0.703   0.627  1.00  0.00           O  
HETATM   29  O   UNL     1       1.679  -2.718  -0.898  1.00  0.00           O  
HETATM   30  O   UNL     1       4.838  -3.429  -1.526  1.00  0.00           O  
HETATM   31  O   UNL     1       3.894  -0.382   0.133  1.00  0.00           O  
HETATM   32  O   UNL     1       6.503   0.597  -0.876  1.00  0.00           O  
HETATM   33  H   UNL     1      -4.462   1.645   1.083  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.432   1.983  -0.664  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.899  -0.406  -1.135  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.929  -0.744   0.612  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.819   0.838   0.886  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.788   1.176  -0.862  1.00  0.00           H  
HETATM   39  H   UNL     1      -7.255  -1.213  -1.332  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.286  -1.551   0.415  1.00  0.00           H  
HETATM   41  H   UNL     1      -9.175   0.031   0.688  1.00  0.00           H  
HETATM   42  H   UNL     1      -9.144   0.369  -1.059  1.00  0.00           H  
HETATM   43  H   UNL     1      -9.611  -2.020  -1.530  1.00  0.00           H  
HETATM   44  H   UNL     1      -9.642  -2.358   0.217  1.00  0.00           H  
HETATM   45  H   UNL     1       1.825   0.145   2.501  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.107   1.660   2.267  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.385   0.428  -0.514  1.00  0.00           H  
HETATM   48  H   UNL     1       0.344   3.267   0.345  1.00  0.00           H  
HETATM   49  H   UNL     1       2.020   1.097  -0.999  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.541  -0.610   2.879  1.00  0.00           H  
HETATM   51  H   UNL     1       0.609   3.491  -2.019  1.00  0.00           H  
HETATM   52  H   UNL     1       2.494   3.461  -1.705  1.00  0.00           H  
HETATM   53  H   UNL     1       2.774   3.879   0.002  1.00  0.00           H  
HETATM   54  H   UNL     1       4.801   3.282  -1.112  1.00  0.00           H  
HETATM   55  H   UNL     1     -11.531  -0.776   0.491  1.00  0.00           H  
HETATM   56  H   UNL     1     -11.501  -0.438  -1.256  1.00  0.00           H  
HETATM   57  H   UNL     1     -11.937  -2.061  -0.672  1.00  0.00           H  
HETATM   58  H   UNL     1       2.483  -2.287   2.520  1.00  0.00           H  
HETATM   59  H   UNL     1       4.210  -2.263   2.088  1.00  0.00           H  
HETATM   60  H   UNL     1       3.182  -3.439   0.342  1.00  0.00           H  
HETATM   61  H   UNL     1       3.631  -1.873  -2.206  1.00  0.00           H  
HETATM   62  H   UNL     1       5.579  -1.631   0.154  1.00  0.00           H  
HETATM   63  H   UNL     1       6.255  -0.962  -2.209  1.00  0.00           H  
HETATM   64  H   UNL     1       4.942   0.239  -2.181  1.00  0.00           H  
HETATM   65  H   UNL     1       3.697  -0.670   3.793  1.00  0.00           H  
HETATM   66  H   UNL     1       1.635  -3.491  -1.477  1.00  0.00           H  
HETATM   67  H   UNL     1       5.602  -3.275  -2.098  1.00  0.00           H  
HETATM   68  H   UNL     1       7.017   1.173  -1.458  1.00  0.00           H  
CONECT    1   14   20   20    2                                       
CONECT    2    1    3   33   34                                       
CONECT    3    2    4   35   36                                       
CONECT    4    3    5   37   38                                       
CONECT    5    4    6   39   40                                       
CONECT    6    5    7   41   42                                       
CONECT    7    6   19   43   44                                       
CONECT    8   28   16    9   45                                       
CONECT    9    8   10   13   46                                       
CONECT   10   11    9   14   47                                       
CONECT   11   12   15   10   48                                       
CONECT   12   17   16   11   49                                       
CONECT   13    9   50                                                 
CONECT   14   10    1                                                 
CONECT   15   11   51                                                 
CONECT   16   12    8                                                 
CONECT   17   12   18   52   53                                       
CONECT   18   17   54                                                 
CONECT   19    7   55   56   57                                       
CONECT   20    1    1                                                 
CONECT   21   22   27   58   59                                       
CONECT   22   23   31   21   28                                       
CONECT   23   24   29   22   60                                       
CONECT   24   30   25   23   61                                       
CONECT   25   24   26   31   62                                       
CONECT   26   25   32   63   64                                       
CONECT   27   21   65                                                 
CONECT   28   22    8                                                 
CONECT   29   23   66                                                 
CONECT   30   24   67                                                 
CONECT   31   25   22                                                 
CONECT   32   26   68                                                 
CONECT   33    2                                                      
CONECT   34    2                                                      
CONECT   35    3                                                      
CONECT   36    3                                                      
CONECT   37    4                                                      
CONECT   38    4                                                      
CONECT   39    5                                                      
CONECT   40    5                                                      
CONECT   41    6                                                      
CONECT   42    6                                                      
CONECT   43    7                                                      
CONECT   44    7                                                      
CONECT   45    8                                                      
CONECT   46    9                                                      
CONECT   47   10                                                      
CONECT   48   11                                                      
CONECT   49   12                                                      
CONECT   50   13                                                      
CONECT   51   15                                                      
CONECT   52   17                                                      
CONECT   53   17                                                      
CONECT   54   18                                                      
CONECT   55   19                                                      
CONECT   56   19                                                      
CONECT   57   19                                                      
CONECT   58   21                                                      
CONECT   59   21                                                      
CONECT   60   23                                                      
CONECT   61   24                                                      
CONECT   62   25                                                      
CONECT   63   26                                                      
CONECT   64   26                                                      
CONECT   65   27                                                      
CONECT   66   29                                                      
CONECT   67   30                                                      
CONECT   68   32                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
