COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.105  -1.046  -2.245  1.00  0.00           C  
HETATM    2  C   UNL     1       1.037  -0.722  -3.226  1.00  0.00           C  
HETATM    3  C   UNL     1       2.260  -0.186  -2.882  1.00  0.00           C  
HETATM    4  C   UNL     1       2.592   0.028  -1.546  1.00  0.00           C  
HETATM    5  C   UNL     1       1.993  -0.035   0.869  1.00  0.00           C  
HETATM    6  C   UNL     1       1.098   0.428   3.156  1.00  0.00           C  
HETATM    7  C   UNL     1       0.332   0.953   5.461  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.973   1.224   6.206  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.835  -0.041   6.144  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.317  -0.225   4.707  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.360  -0.658   2.462  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.553  -1.151   0.157  1.00  0.00           C  
HETATM   13  C   UNL     1       0.418  -0.817  -0.899  1.00  0.00           C  
HETATM   14  C   UNL     1       1.667  -0.267  -0.551  1.00  0.00           C  
HETATM   15  C   UNL     1       0.901  -0.061   1.867  1.00  0.00           C  
HETATM   16  C   UNL     1       0.053   0.394   4.090  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.160  -0.150   3.745  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.344  -0.618   1.521  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.397  -1.435  -3.911  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.955  -0.072  -4.271  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.853   0.970  -4.363  1.00  0.00           C  
HETATM   22  C   UNL     1       0.254   0.418  -5.272  1.00  0.00           C  
HETATM   23  C   UNL     1       0.709  -0.925  -4.682  1.00  0.00           C  
HETATM   24  C   UNL     1       1.932  -1.448  -5.438  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.197   1.828  -6.099  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.317   2.768  -3.941  1.00  0.00           C  
HETATM   27  C   UNL     1       2.003   0.771   7.023  1.00  0.00           C  
HETATM   28  C   UNL     1      -3.039   0.108   7.077  1.00  0.00           C  
HETATM   29  O   UNL     1      -1.094  -1.588  -2.547  1.00  0.00           O  
HETATM   30  O   UNL     1       3.797   0.556  -1.219  1.00  0.00           O  
HETATM   31  O   UNL     1       3.140   0.179   1.210  1.00  0.00           O  
HETATM   32  O   UNL     1       2.305   0.937   3.508  1.00  0.00           O  
HETATM   33  O   UNL     1       1.111   0.013   6.203  1.00  0.00           O  
HETATM   34  O   UNL     1      -1.057  -1.173   6.541  1.00  0.00           O  
HETATM   35  O   UNL     1      -1.514  -1.855  -0.089  1.00  0.00           O  
HETATM   36  O   UNL     1      -0.367  -1.857  -4.781  1.00  0.00           O  
HETATM   37  O   UNL     1      -2.892   0.321  -3.266  1.00  0.00           O  
HETATM   38  O   UNL     1       1.353   1.330  -5.307  1.00  0.00           O  
HETATM   39  N   UNL     1      -1.389   2.213  -4.935  1.00  0.00           N  
HETATM   40  H   UNL     1       2.968   0.068  -3.657  1.00  0.00           H  
HETATM   41  H   UNL     1       0.890   1.884   5.363  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.758   1.472   7.245  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.501   2.051   5.732  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.801  -1.198   4.613  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.036   0.557   4.467  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.316  -1.086   2.200  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.218  -2.129  -4.094  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.466  -0.140  -5.231  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.449   1.167  -3.370  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.133   0.268  -6.279  1.00  0.00           H  
HETATM   51  H   UNL     1       2.245  -2.400  -5.010  1.00  0.00           H  
HETATM   52  H   UNL     1       1.678  -1.587  -6.489  1.00  0.00           H  
HETATM   53  H   UNL     1       2.746  -0.727  -5.354  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.517   2.723  -6.632  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.602   1.202  -6.764  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.074   1.272  -5.765  1.00  0.00           H  
HETATM   57  H   UNL     1      -2.543   3.804  -4.195  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.238   2.186  -3.939  1.00  0.00           H  
HETATM   59  H   UNL     1      -1.859   2.727  -2.953  1.00  0.00           H  
HETATM   60  H   UNL     1       2.575   0.096   7.659  1.00  0.00           H  
HETATM   61  H   UNL     1       2.685   1.338   6.389  1.00  0.00           H  
HETATM   62  H   UNL     1       1.429   1.458   7.645  1.00  0.00           H  
HETATM   63  H   UNL     1      -3.649  -0.793   7.031  1.00  0.00           H  
HETATM   64  H   UNL     1      -2.690   0.259   8.099  1.00  0.00           H  
HETATM   65  H   UNL     1      -3.634   0.966   6.766  1.00  0.00           H  
HETATM   66  H   UNL     1       3.686   1.516  -1.200  1.00  0.00           H  
HETATM   67  H   UNL     1       2.280   1.882   3.303  1.00  0.00           H  
HETATM   68  H   UNL     1      -1.638  -1.944   6.487  1.00  0.00           H  
HETATM   69  H   UNL     1      -3.575  -0.363  -3.237  1.00  0.00           H  
HETATM   70  H   UNL     1       1.014   2.164  -5.660  1.00  0.00           H  
CONECT    1    2    2   13   29                                       
CONECT    2    1    1    3   23                                       
CONECT    3    2    4    4   40                                       
CONECT    4    3    3   14   30                                       
CONECT    5   14   15   31   31                                       
CONECT    6   15   15   16   32                                       
CONECT    7    8   16   33   41                                       
CONECT    8    7    9   42   43                                       
CONECT    9    8   10   28   34                                       
CONECT   10    9   17   44   45                                       
CONECT   11   17   18   18   46                                       
CONECT   12   13   18   35   35                                       
CONECT   13    1   12   14   14                                       
CONECT   14    4    5   13   13                                       
CONECT   15    5    6    6   18                                       
CONECT   16    6    7   17   17                                       
CONECT   17   10   11   16   16                                       
CONECT   18   11   11   12   15                                       
CONECT   19   20   29   36   47                                       
CONECT   20   19   21   37   48                                       
CONECT   21   20   22   39   49                                       
CONECT   22   21   23   38   50                                       
CONECT   23    2   22   24   36                                       
CONECT   24   23   51   52   53                                       
CONECT   25   39   54   55   56                                       
CONECT   26   39   57   58   59                                       
CONECT   27   33   60   61   62                                       
CONECT   28    9   63   64   65                                       
CONECT   29    1   19                                                 
CONECT   30    4   66                                                 
CONECT   31    5    5                                                 
CONECT   32    6   67                                                 
CONECT   33    7   27                                                 
CONECT   34    9   68                                                 
CONECT   35   12   12                                                 
CONECT   36   19   23                                                 
CONECT   37   20   69                                                 
CONECT   38   22   70                                                 
CONECT   39   21   25   26                                            
CONECT   40    3                                                      
CONECT   41    7                                                      
CONECT   42    8                                                      
CONECT   43    8                                                      
CONECT   44   10                                                      
CONECT   45   10                                                      
CONECT   46   11                                                      
CONECT   47   19                                                      
CONECT   48   20                                                      
CONECT   49   21                                                      
CONECT   50   22                                                      
CONECT   51   24                                                      
CONECT   52   24                                                      
CONECT   53   24                                                      
CONECT   54   25                                                      
CONECT   55   25                                                      
CONECT   56   25                                                      
CONECT   57   26                                                      
CONECT   58   26                                                      
CONECT   59   26                                                      
CONECT   60   27                                                      
CONECT   61   27                                                      
CONECT   62   27                                                      
CONECT   63   28                                                      
CONECT   64   28                                                      
CONECT   65   28                                                      
CONECT   66   30                                                      
CONECT   67   32                                                      
CONECT   68   34                                                      
CONECT   69   37                                                      
CONECT   70   38                                                      
MASTER        0    0    0    0    0    0    0    0   70    0   70    0
END
