COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.935   5.062  -1.260  1.00  0.00           C  
HETATM    2  C   UNL     1       2.196  -3.017  -1.613  1.00  0.00           C  
HETATM    3  C   UNL     1       0.772  -0.346   0.197  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.358   0.198   1.033  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.400  -0.536   2.374  1.00  0.00           C  
HETATM    6  C   UNL     1       0.869  -0.218   3.169  1.00  0.00           C  
HETATM    7  C   UNL     1       0.869   1.261   3.559  1.00  0.00           C  
HETATM    8  C   UNL     1       0.907  -1.079   4.433  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.696   0.760   0.636  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.995   1.371   0.442  1.00  0.00           C  
HETATM   11  C   UNL     1      -6.238   0.944  -0.296  1.00  0.00           C  
HETATM   12  C   UNL     1       4.965   2.917  -0.891  1.00  0.00           C  
HETATM   13  C   UNL     1      -6.530   1.492  -1.531  1.00  0.00           C  
HETATM   14  C   UNL     1      -7.671   1.102  -2.208  1.00  0.00           C  
HETATM   15  C   UNL     1      -8.518   0.163  -1.650  1.00  0.00           C  
HETATM   16  C   UNL     1      -8.224  -0.386  -0.415  1.00  0.00           C  
HETATM   17  C   UNL     1      -7.082   0.001   0.259  1.00  0.00           C  
HETATM   18  C   UNL     1       3.826   1.931  -0.953  1.00  0.00           C  
HETATM   19  C   UNL     1       4.280   0.591  -0.370  1.00  0.00           C  
HETATM   20  C   UNL     1       3.125  -0.410  -0.432  1.00  0.00           C  
HETATM   21  C   UNL     1       3.614  -1.782   0.034  1.00  0.00           C  
HETATM   22  C   UNL     1       2.495  -2.810  -0.145  1.00  0.00           C  
HETATM   23  C   UNL     1       2.954  -4.202   0.349  1.00  0.00           C  
HETATM   24  C   UNL     1       2.271  -5.139  -0.672  1.00  0.00           C  
HETATM   25  N   UNL     1       2.076  -4.329  -1.880  1.00  0.00           N  
HETATM   26  N   UNL     1       2.039   0.044   0.440  1.00  0.00           N  
HETATM   27  N   UNL     1      -1.627   0.000   0.328  1.00  0.00           N  
HETATM   28  O   UNL     1       4.795   4.167  -1.351  1.00  0.00           O  
HETATM   29  O   UNL     1       6.030   2.582  -0.429  1.00  0.00           O  
HETATM   30  O   UNL     1       2.077  -2.128  -2.430  1.00  0.00           O  
HETATM   31  O   UNL     1       0.541  -1.135  -0.694  1.00  0.00           O  
HETATM   32  O   UNL     1      -2.583   1.671   1.433  1.00  0.00           O  
HETATM   33  O   UNL     1      -3.888   0.511   0.062  1.00  0.00           O  
HETATM   34  H   UNL     1       6.229   5.171  -0.216  1.00  0.00           H  
HETATM   35  H   UNL     1       6.766   4.651  -1.831  1.00  0.00           H  
HETATM   36  H   UNL     1       5.663   6.038  -1.664  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.201   1.263   1.206  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.273  -0.211   2.939  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.459  -1.610   2.199  1.00  0.00           H  
HETATM   40  H   UNL     1       1.744  -0.432   2.556  1.00  0.00           H  
HETATM   41  H   UNL     1       0.768   1.874   2.663  1.00  0.00           H  
HETATM   42  H   UNL     1       0.034   1.460   4.231  1.00  0.00           H  
HETATM   43  H   UNL     1       1.805   1.505   4.062  1.00  0.00           H  
HETATM   44  H   UNL     1       0.907  -2.133   4.155  1.00  0.00           H  
HETATM   45  H   UNL     1       1.811  -0.853   4.999  1.00  0.00           H  
HETATM   46  H   UNL     1       0.032  -0.865   5.046  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.757   2.403   0.187  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.165   1.292   1.515  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.869   2.226  -1.967  1.00  0.00           H  
HETATM   50  H   UNL     1      -7.900   1.530  -3.172  1.00  0.00           H  
HETATM   51  H   UNL     1      -9.409  -0.142  -2.178  1.00  0.00           H  
HETATM   52  H   UNL     1      -8.887  -1.120   0.021  1.00  0.00           H  
HETATM   53  H   UNL     1      -6.851  -0.430   1.222  1.00  0.00           H  
HETATM   54  H   UNL     1       2.984   2.312  -0.375  1.00  0.00           H  
HETATM   55  H   UNL     1       3.522   1.792  -1.990  1.00  0.00           H  
HETATM   56  H   UNL     1       5.122   0.210  -0.948  1.00  0.00           H  
HETATM   57  H   UNL     1       4.585   0.731   0.667  1.00  0.00           H  
HETATM   58  H   UNL     1       2.762  -0.482  -1.457  1.00  0.00           H  
HETATM   59  H   UNL     1       4.479  -2.080  -0.558  1.00  0.00           H  
HETATM   60  H   UNL     1       3.894  -1.730   1.087  1.00  0.00           H  
HETATM   61  H   UNL     1       1.597  -2.492   0.386  1.00  0.00           H  
HETATM   62  H   UNL     1       4.039  -4.295   0.299  1.00  0.00           H  
HETATM   63  H   UNL     1       2.594  -4.396   1.359  1.00  0.00           H  
HETATM   64  H   UNL     1       2.912  -5.994  -0.887  1.00  0.00           H  
HETATM   65  H   UNL     1       1.308  -5.476  -0.289  1.00  0.00           H  
HETATM   66  H   UNL     1       1.891  -4.694  -2.760  1.00  0.00           H  
HETATM   67  H   UNL     1       2.231   0.625   1.192  1.00  0.00           H  
HETATM   68  H   UNL     1      -1.698  -0.679  -0.361  1.00  0.00           H  
CONECT    1   28   34   35   36                                       
CONECT    2   25   22   30   30                                       
CONECT    3    4   26   31   31                                       
CONECT    4   27    5    3   37                                       
CONECT    5    4    6   38   39                                       
CONECT    6    7    5    8   40                                       
CONECT    7    6   41   42   43                                       
CONECT    8    6   44   45   46                                       
CONECT    9   27   33   32   32                                       
CONECT   10   33   11   47   48                                       
CONECT   11   13   10   17   17                                       
CONECT   12   29   29   28   18                                       
CONECT   13   14   14   11   49                                       
CONECT   14   13   13   15   50                                       
CONECT   15   14   16   16   51                                       
CONECT   16   15   15   17   52                                       
CONECT   17   11   11   16   53                                       
CONECT   18   19   12   54   55                                       
CONECT   19   20   18   56   57                                       
CONECT   20   19   21   26   58                                       
CONECT   21   22   20   59   60                                       
CONECT   22   23    2   21   61                                       
CONECT   23   24   22   62   63                                       
CONECT   24   23   25   64   65                                       
CONECT   25   24    2   66                                            
CONECT   26   20    3   67                                            
CONECT   27    4    9   68                                            
CONECT   28   12    1                                                 
CONECT   29   12   12                                                 
CONECT   30    2    2                                                 
CONECT   31    3    3                                                 
CONECT   32    9    9                                                 
CONECT   33    9   10                                                 
CONECT   34    1                                                      
CONECT   35    1                                                      
CONECT   36    1                                                      
CONECT   37    4                                                      
CONECT   38    5                                                      
CONECT   39    5                                                      
CONECT   40    6                                                      
CONECT   41    7                                                      
CONECT   42    7                                                      
CONECT   43    7                                                      
CONECT   44    8                                                      
CONECT   45    8                                                      
CONECT   46    8                                                      
CONECT   47   10                                                      
CONECT   48   10                                                      
CONECT   49   13                                                      
CONECT   50   14                                                      
CONECT   51   15                                                      
CONECT   52   16                                                      
CONECT   53   17                                                      
CONECT   54   18                                                      
CONECT   55   18                                                      
CONECT   56   19                                                      
CONECT   57   19                                                      
CONECT   58   20                                                      
CONECT   59   21                                                      
CONECT   60   21                                                      
CONECT   61   22                                                      
CONECT   62   23                                                      
CONECT   63   23                                                      
CONECT   64   24                                                      
CONECT   65   24                                                      
CONECT   66   25                                                      
CONECT   67   26                                                      
CONECT   68   27                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
