COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.085   0.075  -4.129  1.00  0.00           C  
HETATM    2  N   UNL     1      -0.922   0.340  -3.393  1.00  0.00           N  
HETATM    3  C   UNL     1      -2.002  -0.179  -5.493  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.321   0.072  -3.499  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.918   0.171  -2.056  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.151  -0.445  -6.217  1.00  0.00           C  
HETATM    7  F   UNL     1      -0.800  -0.176  -6.110  1.00  0.00           F  
HETATM    8  C   UNL     1      -4.466  -0.188  -4.226  1.00  0.00           C  
HETATM    9  N   UNL     1       0.163   0.526  -1.335  1.00  0.00           N  
HETATM   10  O   UNL     1      -1.891  -0.301  -1.500  1.00  0.00           O  
HETATM   11  C   UNL     1      -4.382  -0.447  -5.584  1.00  0.00           C  
HETATM   12  C   UNL     1       0.168   0.342   0.118  1.00  0.00           C  
HETATM   13  C   UNL     1       1.335   1.095  -2.005  1.00  0.00           C  
HETATM   14  F   UNL     1      -5.504  -0.702  -6.293  1.00  0.00           F  
HETATM   15  C   UNL     1      -0.377   1.602   0.793  1.00  0.00           C  
HETATM   16  C   UNL     1       2.290  -0.029  -2.407  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.372   1.413   2.288  1.00  0.00           C  
HETATM   18  C   UNL     1       3.514   0.565  -3.107  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.481   0.880   2.920  1.00  0.00           C  
HETATM   20  C   UNL     1       0.738   1.777   3.026  1.00  0.00           C  
HETATM   21  C   UNL     1       4.468  -0.560  -3.509  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.477   0.701   4.289  1.00  0.00           C  
HETATM   23  C   UNL     1       0.744   1.604   4.397  1.00  0.00           C  
HETATM   24  C   UNL     1       5.692   0.034  -4.209  1.00  0.00           C  
HETATM   25  C   UNL     1      -0.364   1.065   5.032  1.00  0.00           C  
HETATM   26  C   UNL     1       6.647  -1.091  -4.611  1.00  0.00           C  
HETATM   27  O   UNL     1      -0.360   0.894   6.381  1.00  0.00           O  
HETATM   28  C   UNL     1       7.871  -0.496  -5.310  1.00  0.00           C  
HETATM   29  C   UNL     1       0.356  -0.313   6.642  1.00  0.00           C  
HETATM   30  C   UNL     1      -0.413  -1.483   6.085  1.00  0.00           C  
HETATM   31  C   UNL     1       0.528  -0.488   8.152  1.00  0.00           C  
HETATM   32  C   UNL     1       1.732  -0.245   5.976  1.00  0.00           C  
HETATM   33  O   UNL     1       0.141  -2.706   6.071  1.00  0.00           O  
HETATM   34  O   UNL     1      -1.529  -1.322   5.652  1.00  0.00           O  
HETATM   35  C   UNL     1      -0.847  -0.557   8.818  1.00  0.00           C  
HETATM   36  H   UNL     1      -0.120   0.646  -3.845  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.388   0.273  -2.440  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.087  -0.646  -7.276  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.428  -0.191  -3.735  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.459  -0.509   0.378  1.00  0.00           H  
HETATM   41  H   UNL     1       1.187   0.160   0.458  1.00  0.00           H  
HETATM   42  H   UNL     1       1.845   1.779  -1.326  1.00  0.00           H  
HETATM   43  H   UNL     1       1.017   1.638  -2.895  1.00  0.00           H  
HETATM   44  H   UNL     1       0.250   2.454   0.533  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.396   1.784   0.453  1.00  0.00           H  
HETATM   46  H   UNL     1       1.780  -0.713  -3.086  1.00  0.00           H  
HETATM   47  H   UNL     1       2.608  -0.572  -1.517  1.00  0.00           H  
HETATM   48  H   UNL     1       4.024   1.248  -2.428  1.00  0.00           H  
HETATM   49  H   UNL     1       3.195   1.107  -3.997  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.348   0.597   2.341  1.00  0.00           H  
HETATM   51  H   UNL     1       1.601   2.197   2.531  1.00  0.00           H  
HETATM   52  H   UNL     1       3.958  -1.244  -4.188  1.00  0.00           H  
HETATM   53  H   UNL     1       4.787  -1.103  -2.619  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.342   0.280   4.782  1.00  0.00           H  
HETATM   55  H   UNL     1       1.613   1.888   4.973  1.00  0.00           H  
HETATM   56  H   UNL     1       6.202   0.717  -3.530  1.00  0.00           H  
HETATM   57  H   UNL     1       5.374   0.576  -5.099  1.00  0.00           H  
HETATM   58  H   UNL     1       6.137  -1.775  -5.290  1.00  0.00           H  
HETATM   59  H   UNL     1       6.965  -1.633  -3.720  1.00  0.00           H  
HETATM   60  H   UNL     1       8.551  -1.298  -5.597  1.00  0.00           H  
HETATM   61  H   UNL     1       7.552   0.045  -6.201  1.00  0.00           H  
HETATM   62  H   UNL     1       8.381   0.186  -4.632  1.00  0.00           H  
HETATM   63  H   UNL     1       1.084   0.358   8.555  1.00  0.00           H  
HETATM   64  H   UNL     1       1.074  -1.410   8.351  1.00  0.00           H  
HETATM   65  H   UNL     1       2.211   0.701   6.229  1.00  0.00           H  
HETATM   66  H   UNL     1       2.349  -1.070   6.332  1.00  0.00           H  
HETATM   67  H   UNL     1       1.616  -0.316   4.895  1.00  0.00           H  
HETATM   68  H   UNL     1      -0.351  -3.457   5.714  1.00  0.00           H  
HETATM   69  H   UNL     1      -0.725  -0.681   9.894  1.00  0.00           H  
HETATM   70  H   UNL     1      -1.394   0.364   8.618  1.00  0.00           H  
HETATM   71  H   UNL     1      -1.404  -1.403   8.415  1.00  0.00           H  
CONECT    1    2    3    4    4                                       
CONECT    2    1    5   36                                            
CONECT    3    1    6    6    7                                       
CONECT    4    1    1    8   37                                       
CONECT    5    2    9   10   10                                       
CONECT    6    3    3   11   38                                       
CONECT    7    3                                                      
CONECT    8    4   11   11   39                                       
CONECT    9    5   12   13                                            
CONECT   10    5    5                                                 
CONECT   11    6    8    8   14                                       
CONECT   12    9   15   40   41                                       
CONECT   13    9   16   42   43                                       
CONECT   14   11                                                      
CONECT   15   12   17   44   45                                       
CONECT   16   13   18   46   47                                       
CONECT   17   15   19   20   20                                       
CONECT   18   16   21   48   49                                       
CONECT   19   17   22   22   50                                       
CONECT   20   17   17   23   51                                       
CONECT   21   18   24   52   53                                       
CONECT   22   19   19   25   54                                       
CONECT   23   20   25   25   55                                       
CONECT   24   21   26   56   57                                       
CONECT   25   22   23   23   27                                       
CONECT   26   24   28   58   59                                       
CONECT   27   25   29                                                 
CONECT   28   26   60   61   62                                       
CONECT   29   27   30   31   32                                       
CONECT   30   29   33   34   34                                       
CONECT   31   29   35   63   64                                       
CONECT   32   29   65   66   67                                       
CONECT   33   30   68                                                 
CONECT   34   30   30                                                 
CONECT   35   31   69   70   71                                       
CONECT   36    2                                                      
CONECT   37    4                                                      
CONECT   38    6                                                      
CONECT   39    8                                                      
CONECT   40   12                                                      
CONECT   41   12                                                      
CONECT   42   13                                                      
CONECT   43   13                                                      
CONECT   44   15                                                      
CONECT   45   15                                                      
CONECT   46   16                                                      
CONECT   47   16                                                      
CONECT   48   18                                                      
CONECT   49   18                                                      
CONECT   50   19                                                      
CONECT   51   20                                                      
CONECT   52   21                                                      
CONECT   53   21                                                      
CONECT   54   22                                                      
CONECT   55   23                                                      
CONECT   56   24                                                      
CONECT   57   24                                                      
CONECT   58   26                                                      
CONECT   59   26                                                      
CONECT   60   28                                                      
CONECT   61   28                                                      
CONECT   62   28                                                      
CONECT   63   31                                                      
CONECT   64   31                                                      
CONECT   65   32                                                      
CONECT   66   32                                                      
CONECT   67   32                                                      
CONECT   68   33                                                      
CONECT   69   35                                                      
CONECT   70   35                                                      
CONECT   71   35                                                      
MASTER        0    0    0    0    0    0    0    0   71    0   71    0
END
