COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -5.425   2.500   0.406  1.00  0.00           O  
HETATM    2  C   UNL     1      -4.498   1.773   0.152  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.722   1.076   1.245  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.420   1.810   1.522  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.569  -0.401   0.939  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.342  -0.826  -0.486  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.061   0.029  -1.533  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.057   1.523  -1.270  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.057  -2.206  -0.646  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.885  -1.015  -0.908  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.992  -1.658   0.121  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.325  -3.165   0.235  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.172  -1.046   1.506  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.627  -1.063   1.938  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.367   0.321  -1.421  1.00  0.00           C  
HETATM   16  C   UNL     1       0.116   0.461  -1.412  1.00  0.00           C  
HETATM   17  C   UNL     1       0.961  -0.373  -0.881  1.00  0.00           C  
HETATM   18  C   UNL     1       0.492  -1.646  -0.252  1.00  0.00           C  
HETATM   19  C   UNL     1       0.683  -2.770  -1.285  1.00  0.00           C  
HETATM   20  C   UNL     1       2.434  -0.049  -0.955  1.00  0.00           C  
HETATM   21  C   UNL     1       3.203  -0.511   0.275  1.00  0.00           C  
HETATM   22  C   UNL     1       4.688  -0.487  -0.019  1.00  0.00           C  
HETATM   23  O   UNL     1       5.566  -0.857   0.928  1.00  0.00           O  
HETATM   24  O   UNL     1       5.083  -0.135  -1.105  1.00  0.00           O  
HETATM   25  C   UNL     1       2.817  -1.948   0.637  1.00  0.00           C  
HETATM   26  C   UNL     1       1.329  -2.000   0.975  1.00  0.00           C  
HETATM   27  C   UNL     1       2.711   1.408  -1.264  1.00  0.00           C  
HETATM   28  C   UNL     1       2.641   2.365  -0.091  1.00  0.00           C  
HETATM   29  C   UNL     1       1.196   2.730   0.257  1.00  0.00           C  
HETATM   30  C   UNL     1       3.356   3.672  -0.501  1.00  0.00           C  
HETATM   31  C   UNL     1       3.339   1.829   1.156  1.00  0.00           C  
HETATM   32  C   UNL     1       2.901   0.404   1.461  1.00  0.00           C  
HETATM   33  H   UNL     1      -4.339   1.158   2.170  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.631   2.858   1.731  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.925   1.360   2.383  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.770   1.737   0.650  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.585  -0.839   1.201  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.611  -0.173  -2.515  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.106  -0.320  -1.589  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.770   2.017  -1.948  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.083   1.967  -1.450  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.136  -2.066  -0.583  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.803  -2.637  -1.614  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.731  -2.878   0.148  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.915  -1.699  -1.798  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.361  -3.606  -0.762  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.556  -3.664   0.825  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.292  -3.288   0.722  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.606  -1.669   2.224  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.736  -0.056   1.535  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.719  -0.552   2.907  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.952  -2.096   2.109  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.718   0.457  -2.457  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.794   1.136  -0.832  1.00  0.00           H  
HETATM   55  H   UNL     1       0.514   1.324  -1.941  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.040  -2.648  -2.092  1.00  0.00           H  
HETATM   57  H   UNL     1       1.693  -2.723  -1.692  1.00  0.00           H  
HETATM   58  H   UNL     1       0.529  -3.736  -0.803  1.00  0.00           H  
HETATM   59  H   UNL     1       2.838  -0.637  -1.814  1.00  0.00           H  
HETATM   60  H   UNL     1       6.503  -0.825   0.693  1.00  0.00           H  
HETATM   61  H   UNL     1       3.058  -2.615  -0.186  1.00  0.00           H  
HETATM   62  H   UNL     1       3.395  -2.261   1.514  1.00  0.00           H  
HETATM   63  H   UNL     1       1.123  -1.295   1.784  1.00  0.00           H  
HETATM   64  H   UNL     1       1.086  -3.007   1.321  1.00  0.00           H  
HETATM   65  H   UNL     1       3.733   1.474  -1.693  1.00  0.00           H  
HETATM   66  H   UNL     1       2.060   1.759  -2.070  1.00  0.00           H  
HETATM   67  H   UNL     1       0.646   1.826   0.519  1.00  0.00           H  
HETATM   68  H   UNL     1       1.189   3.417   1.103  1.00  0.00           H  
HETATM   69  H   UNL     1       0.725   3.206  -0.602  1.00  0.00           H  
HETATM   70  H   UNL     1       2.857   4.102  -1.369  1.00  0.00           H  
HETATM   71  H   UNL     1       3.321   4.380   0.327  1.00  0.00           H  
HETATM   72  H   UNL     1       4.395   3.455  -0.750  1.00  0.00           H  
HETATM   73  H   UNL     1       4.418   1.892   1.038  1.00  0.00           H  
HETATM   74  H   UNL     1       3.064   2.469   2.009  1.00  0.00           H  
HETATM   75  H   UNL     1       1.833   0.387   1.679  1.00  0.00           H  
HETATM   76  H   UNL     1       3.439   0.041   2.342  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    8                                       
CONECT    3    4    2    5   33                                       
CONECT    4    3   34   35   36                                       
CONECT    5    3   14    6   37                                       
CONECT    6    7    5    9   10                                       
CONECT    7    8    6   38   39                                       
CONECT    8    2    7   40   41                                       
CONECT    9    6   42   43   44                                       
CONECT   10    6   15   11   45                                       
CONECT   11   13   10   12   18                                       
CONECT   12   11   46   47   48                                       
CONECT   13   14   11   49   50                                       
CONECT   14    5   13   51   52                                       
CONECT   15   10   16   53   54                                       
CONECT   16   15   17   17   55                                       
CONECT   17   16   16   18   20                                       
CONECT   18   11   17   26   19                                       
CONECT   19   18   56   57   58                                       
CONECT   20   17   27   21   59                                       
CONECT   21   20   25   22   32                                       
CONECT   22   21   24   24   23                                       
CONECT   23   22   60                                                 
CONECT   24   22   22                                                 
CONECT   25   26   21   61   62                                       
CONECT   26   18   25   63   64                                       
CONECT   27   20   28   65   66                                       
CONECT   28   27   30   29   31                                       
CONECT   29   28   67   68   69                                       
CONECT   30   28   70   71   72                                       
CONECT   31   28   32   73   74                                       
CONECT   32   21   31   75   76                                       
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    4                                                      
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38    7                                                      
CONECT   39    7                                                      
CONECT   40    8                                                      
CONECT   41    8                                                      
CONECT   42    9                                                      
CONECT   43    9                                                      
CONECT   44    9                                                      
CONECT   45   10                                                      
CONECT   46   12                                                      
CONECT   47   12                                                      
CONECT   48   12                                                      
CONECT   49   13                                                      
CONECT   50   13                                                      
CONECT   51   14                                                      
CONECT   52   14                                                      
CONECT   53   15                                                      
CONECT   54   15                                                      
CONECT   55   16                                                      
CONECT   56   19                                                      
CONECT   57   19                                                      
CONECT   58   19                                                      
CONECT   59   20                                                      
CONECT   60   23                                                      
CONECT   61   25                                                      
CONECT   62   25                                                      
CONECT   63   26                                                      
CONECT   64   26                                                      
CONECT   65   27                                                      
CONECT   66   27                                                      
CONECT   67   29                                                      
CONECT   68   29                                                      
CONECT   69   29                                                      
CONECT   70   30                                                      
CONECT   71   30                                                      
CONECT   72   30                                                      
CONECT   73   31                                                      
CONECT   74   31                                                      
CONECT   75   32                                                      
CONECT   76   32                                                      
MASTER        0    0    0    0    0    0    0    0   76    0   76    0
END
