COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.505  -0.471  -0.736  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.163   0.873  -0.728  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.426   2.866   0.083  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.112   2.372   1.497  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.358   3.872  -0.354  1.00  0.00           C  
HETATM    6  C   UNL     1       4.270  -2.519  -0.072  1.00  0.00           C  
HETATM    7  C   UNL     1       5.582  -1.787   0.053  1.00  0.00           C  
HETATM    8  C   UNL     1       7.373  -0.765  -0.973  1.00  0.00           C  
HETATM    9  C   UNL     1       7.951  -0.466   0.246  1.00  0.00           C  
HETATM   10  C   UNL     1       7.309  -0.855   1.412  1.00  0.00           C  
HETATM   11  C   UNL     1       6.102  -1.528   1.308  1.00  0.00           C  
HETATM   12  C   UNL     1       9.026   2.146   0.366  1.00  0.00           C  
HETATM   13  C   UNL     1      10.290   3.005   0.430  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.740   1.059  -1.336  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.928   0.272  -0.779  1.00  0.00           C  
HETATM   16  C   UNL     1      -6.247   0.761   0.635  1.00  0.00           C  
HETATM   17  N   UNL     1       0.097   1.246  -0.599  1.00  0.00           N  
HETATM   18  C   UNL     1       1.075   0.373  -0.475  1.00  0.00           C  
HETATM   19  C   UNL     1       0.810  -0.997  -0.475  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.516  -1.427  -0.609  1.00  0.00           C  
HETATM   21  C   UNL     1       1.909  -1.976  -0.337  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.003  -0.581  -0.888  1.00  0.00           C  
HETATM   23  N   UNL     1      -3.539   0.756  -0.547  1.00  0.00           N  
HETATM   24  C   UNL     1      -2.434   1.680  -0.882  1.00  0.00           C  
HETATM   25  O   UNL     1       1.666  -3.167  -0.338  1.00  0.00           O  
HETATM   26  N   UNL     1       3.181  -1.548  -0.209  1.00  0.00           N  
HETATM   27  N   UNL     1       6.222  -1.407  -1.034  1.00  0.00           N  
HETATM   28  S   UNL     1       9.488   0.392   0.318  1.00  0.00           S  
HETATM   29  O   UNL     1      10.056  -0.008   1.557  1.00  0.00           O  
HETATM   30  O   UNL     1      10.123   0.078  -0.914  1.00  0.00           O  
HETATM   31  C   UNL     1      -7.435  -0.026   1.191  1.00  0.00           C  
HETATM   32  C   UNL     1      -8.654   0.186   0.291  1.00  0.00           C  
HETATM   33  C   UNL     1      -8.335  -0.304  -1.123  1.00  0.00           C  
HETATM   34  C   UNL     1      -7.147   0.484  -1.679  1.00  0.00           C  
HETATM   35  C   UNL     1      -9.842  -0.601   0.848  1.00  0.00           C  
HETATM   36  F   UNL     1     -10.134  -0.154   2.141  1.00  0.00           F  
HETATM   37  F   UNL     1     -10.957  -0.408   0.025  1.00  0.00           F  
HETATM   38  F   UNL     1      -9.522  -1.963   0.887  1.00  0.00           F  
HETATM   39  H   UNL     1      -3.403   3.348   0.075  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.135   1.890   1.505  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.107   3.217   2.184  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.873   1.656   1.808  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.581   4.224  -1.361  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.352   4.717   0.334  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.380   3.390  -0.346  1.00  0.00           H  
HETATM   46  H   UNL     1       4.296  -3.162  -0.952  1.00  0.00           H  
HETATM   47  H   UNL     1       4.106  -3.126   0.818  1.00  0.00           H  
HETATM   48  H   UNL     1       7.869  -0.470  -1.886  1.00  0.00           H  
HETATM   49  H   UNL     1       7.740  -0.639   2.379  1.00  0.00           H  
HETATM   50  H   UNL     1       5.574  -1.845   2.195  1.00  0.00           H  
HETATM   51  H   UNL     1       8.413   2.336   1.247  1.00  0.00           H  
HETATM   52  H   UNL     1       8.461   2.398  -0.531  1.00  0.00           H  
HETATM   53  H   UNL     1      10.856   2.753   1.328  1.00  0.00           H  
HETATM   54  H   UNL     1      10.904   2.815  -0.450  1.00  0.00           H  
HETATM   55  H   UNL     1      10.013   4.058   0.460  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.573   0.778  -2.375  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.953   2.127  -1.278  1.00  0.00           H  
HETATM   58  H   UNL     1      -5.679  -0.789  -0.749  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.379   0.610   1.276  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.496   1.822   0.605  1.00  0.00           H  
HETATM   61  H   UNL     1       2.092   0.721  -0.372  1.00  0.00           H  
HETATM   62  H   UNL     1      -0.759  -2.479  -0.613  1.00  0.00           H  
HETATM   63  H   UNL     1      -3.259  -0.838  -1.916  1.00  0.00           H  
HETATM   64  H   UNL     1      -3.397  -1.333  -0.204  1.00  0.00           H  
HETATM   65  H   UNL     1      -2.536   2.031  -1.909  1.00  0.00           H  
HETATM   66  H   UNL     1       3.375  -0.598  -0.208  1.00  0.00           H  
HETATM   67  H   UNL     1      -7.186  -1.087   1.222  1.00  0.00           H  
HETATM   68  H   UNL     1      -7.662   0.323   2.199  1.00  0.00           H  
HETATM   69  H   UNL     1      -8.903   1.247   0.261  1.00  0.00           H  
HETATM   70  H   UNL     1      -8.086  -1.364  -1.092  1.00  0.00           H  
HETATM   71  H   UNL     1      -9.204  -0.153  -1.764  1.00  0.00           H  
HETATM   72  H   UNL     1      -7.397   1.544  -1.709  1.00  0.00           H  
HETATM   73  H   UNL     1      -6.920   0.135  -2.687  1.00  0.00           H  
CONECT    1    2   22   20   20                                       
CONECT    2   24   17   17    1                                       
CONECT    3    4   24    5   39                                       
CONECT    4    3   40   41   42                                       
CONECT    5    3   43   44   45                                       
CONECT    6   26    7   46   47                                       
CONECT    7   11    6   27   27                                       
CONECT    8    9    9   27   48                                       
CONECT    9   10   28    8    8                                       
CONECT   10   11   11    9   49                                       
CONECT   11   10   10    7   50                                       
CONECT   12   13   28   51   52                                       
CONECT   13   12   53   54   55                                       
CONECT   14   15   23   56   57                                       
CONECT   15   14   34   16   58                                       
CONECT   16   31   15   59   60                                       
CONECT   17    2    2   18                                            
CONECT   18   17   19   19   61                                       
CONECT   19   18   18   20   21                                       
CONECT   20    1    1   19   62                                       
CONECT   21   19   26   25   25                                       
CONECT   22   23    1   63   64                                       
CONECT   23   24   14   22                                            
CONECT   24    3   23    2   65                                       
CONECT   25   21   21                                                 
CONECT   26   21    6   66                                            
CONECT   27    7    7    8                                            
CONECT   28   30   30    9   12                                       
CONECT   28   29   29                                                 
CONECT   29   28   28                                                 
CONECT   30   28   28                                                 
CONECT   31   32   16   67   68                                       
CONECT   32   35   33   31   69                                       
CONECT   33   32   34   70   71                                       
CONECT   34   33   15   72   73                                       
CONECT   35   37   36   32   38                                       
CONECT   36   35                                                      
CONECT   37   35                                                      
CONECT   38   35                                                      
CONECT   39    3                                                      
CONECT   40    4                                                      
CONECT   41    4                                                      
CONECT   42    4                                                      
CONECT   43    5                                                      
CONECT   44    5                                                      
CONECT   45    5                                                      
CONECT   46    6                                                      
CONECT   47    6                                                      
CONECT   48    8                                                      
CONECT   49   10                                                      
CONECT   50   11                                                      
CONECT   51   12                                                      
CONECT   52   12                                                      
CONECT   53   13                                                      
CONECT   54   13                                                      
CONECT   55   13                                                      
CONECT   56   14                                                      
CONECT   57   14                                                      
CONECT   58   15                                                      
CONECT   59   16                                                      
CONECT   60   16                                                      
CONECT   61   18                                                      
CONECT   62   20                                                      
CONECT   63   22                                                      
CONECT   64   22                                                      
CONECT   65   24                                                      
CONECT   66   26                                                      
CONECT   67   31                                                      
CONECT   68   31                                                      
CONECT   69   32                                                      
CONECT   70   33                                                      
CONECT   71   33                                                      
CONECT   72   34                                                      
CONECT   73   34                                                      
MASTER        0    0    0    0    0    0    0    0   73    0   73    0
END
