COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       3.542  -3.021  -0.488  1.00  0.00           O  
HETATM    2  C   UNL     1       3.439  -1.840  -0.220  1.00  0.00           C  
HETATM    3  C   UNL     1       4.643  -0.988  -0.164  1.00  0.00           C  
HETATM    4  C   UNL     1       4.526   0.369   0.150  1.00  0.00           C  
HETATM    5  C   UNL     1       5.649   1.162   0.202  1.00  0.00           C  
HETATM    6  C   UNL     1       5.902  -1.539  -0.418  1.00  0.00           C  
HETATM    7  C   UNL     1       7.024  -0.744  -0.365  1.00  0.00           C  
HETATM    8  C   UNL     1       6.905   0.612  -0.057  1.00  0.00           C  
HETATM    9  C   UNL     1       8.114   1.467   0.000  1.00  0.00           C  
HETATM   10  C   UNL     1       9.370   0.918  -0.259  1.00  0.00           C  
HETATM   11  C   UNL     1      10.497   1.720  -0.205  1.00  0.00           C  
HETATM   12  N   UNL     1      11.760   1.172  -0.465  1.00  0.00           N  
HETATM   13  C   UNL     1      11.978  -0.143  -0.266  1.00  0.00           C  
HETATM   14  O   UNL     1      11.063  -0.866   0.079  1.00  0.00           O  
HETATM   15  C   UNL     1      13.326  -0.705  -0.468  1.00  0.00           C  
HETATM   16  C   UNL     1      13.529  -2.106  -0.423  1.00  0.00           C  
HETATM   17  C   UNL     1      12.373  -3.039  -0.170  1.00  0.00           C  
HETATM   18  F   UNL     1      12.829  -4.361  -0.183  1.00  0.00           F  
HETATM   19  F   UNL     1      11.807  -2.752   1.077  1.00  0.00           F  
HETATM   20  F   UNL     1      11.409  -2.868  -1.170  1.00  0.00           F  
HETATM   21  C   UNL     1      14.783  -2.597  -0.613  1.00  0.00           C  
HETATM   22  C   UNL     1      15.848  -1.707  -0.848  1.00  0.00           C  
HETATM   23  O   UNL     1      16.974  -2.142  -1.018  1.00  0.00           O  
HETATM   24  N   UNL     1      15.632  -0.379  -0.886  1.00  0.00           N  
HETATM   25  C   UNL     1      14.399   0.129  -0.706  1.00  0.00           C  
HETATM   26  C   UNL     1       7.997   2.822   0.307  1.00  0.00           C  
HETATM   27  C   UNL     1       9.122   3.619   0.360  1.00  0.00           C  
HETATM   28  C   UNL     1      10.374   3.075   0.108  1.00  0.00           C  
HETATM   29  N   UNL     1      11.510   3.885   0.163  1.00  0.00           N  
HETATM   30  C   UNL     1      11.424   4.980  -0.812  1.00  0.00           C  
HETATM   31  C   UNL     1      12.719   5.795  -0.776  1.00  0.00           C  
HETATM   32  C   UNL     1      11.720   4.407   1.521  1.00  0.00           C  
HETATM   33  C   UNL     1      13.015   5.222   1.557  1.00  0.00           C  
HETATM   34  N   UNL     1      12.928   6.318   0.581  1.00  0.00           N  
HETATM   35  C   UNL     1      14.124   7.169   0.639  1.00  0.00           C  
HETATM   36  N   UNL     1       2.224  -1.307   0.020  1.00  0.00           N  
HETATM   37  C   UNL     1       1.029  -2.151  -0.042  1.00  0.00           C  
HETATM   38  C   UNL     1      -0.209  -1.306   0.268  1.00  0.00           C  
HETATM   39  C   UNL     1      -1.457  -2.188   0.204  1.00  0.00           C  
HETATM   40  C   UNL     1      -2.695  -1.343   0.514  1.00  0.00           C  
HETATM   41  C   UNL     1      -3.925  -2.211   0.451  1.00  0.00           C  
HETATM   42  O   UNL     1      -3.822  -3.390   0.184  1.00  0.00           O  
HETATM   43  N   UNL     1      -5.139  -1.678   0.690  1.00  0.00           N  
HETATM   44  C   UNL     1      -6.335  -2.522   0.629  1.00  0.00           C  
HETATM   45  C   UNL     1      -6.537  -3.220   1.975  1.00  0.00           C  
HETATM   46  C   UNL     1      -5.349  -4.142   2.256  1.00  0.00           C  
HETATM   47  C   UNL     1      -6.640  -2.169   3.083  1.00  0.00           C  
HETATM   48  C   UNL     1      -7.825  -4.045   1.934  1.00  0.00           C  
HETATM   49  C   UNL     1      -7.537  -1.668   0.320  1.00  0.00           C  
HETATM   50  O   UNL     1      -7.612  -0.543   0.765  1.00  0.00           O  
HETATM   51  N   UNL     1      -8.530  -2.155  -0.452  1.00  0.00           N  
HETATM   52  C   UNL     1      -9.711  -1.405  -0.902  1.00  0.00           C  
HETATM   53  C   UNL     1     -10.578  -2.373  -1.735  1.00  0.00           C  
HETATM   54  C   UNL     1     -10.119  -3.769  -1.235  1.00  0.00           C  
HETATM   55  O   UNL     1     -10.321  -4.760  -2.244  1.00  0.00           O  
HETATM   56  C   UNL     1      -8.606  -3.526  -0.989  1.00  0.00           C  
HETATM   57  C   UNL     1     -10.492  -0.915   0.290  1.00  0.00           C  
HETATM   58  O   UNL     1     -10.105  -1.163   1.412  1.00  0.00           O  
HETATM   59  N   UNL     1     -11.620  -0.200   0.109  1.00  0.00           N  
HETATM   60  C   UNL     1     -12.379   0.277   1.268  1.00  0.00           C  
HETATM   61  C   UNL     1     -13.588   1.043   0.796  1.00  0.00           C  
HETATM   62  C   UNL     1     -13.497   2.407   0.578  1.00  0.00           C  
HETATM   63  C   UNL     1     -14.599   3.114   0.147  1.00  0.00           C  
HETATM   64  C   UNL     1     -15.808   2.452  -0.071  1.00  0.00           C  
HETATM   65  C   UNL     1     -15.894   1.077   0.151  1.00  0.00           C  
HETATM   66  C   UNL     1     -14.782   0.380   0.577  1.00  0.00           C  
HETATM   67  C   UNL     1     -16.994   3.205  -0.533  1.00  0.00           C  
HETATM   68  S   UNL     1     -17.629   4.684   0.183  1.00  0.00           S  
HETATM   69  C   UNL     1     -18.881   4.722  -0.982  1.00  0.00           C  
HETATM   70  N   UNL     1     -18.778   3.716  -1.784  1.00  0.00           N  
HETATM   71  C   UNL     1     -17.781   2.884  -1.583  1.00  0.00           C  
HETATM   72  C   UNL     1     -17.538   1.674  -2.448  1.00  0.00           C  
HETATM   73  H   UNL     1       3.554   0.795   0.350  1.00  0.00           H  
HETATM   74  H   UNL     1       5.559   2.211   0.444  1.00  0.00           H  
HETATM   75  H   UNL     1       5.994  -2.588  -0.656  1.00  0.00           H  
HETATM   76  H   UNL     1       7.997  -1.170  -0.561  1.00  0.00           H  
HETATM   77  H   UNL     1       9.463  -0.130  -0.501  1.00  0.00           H  
HETATM   78  H   UNL     1      12.477   1.739  -0.788  1.00  0.00           H  
HETATM   79  H   UNL     1      14.960  -3.662  -0.582  1.00  0.00           H  
HETATM   80  H   UNL     1      14.249   1.198  -0.746  1.00  0.00           H  
HETATM   81  H   UNL     1       7.024   3.249   0.503  1.00  0.00           H  
HETATM   82  H   UNL     1       9.028   4.669   0.597  1.00  0.00           H  
HETATM   83  H   UNL     1      11.281   4.568  -1.811  1.00  0.00           H  
HETATM   84  H   UNL     1      10.581   5.625  -0.562  1.00  0.00           H  
HETATM   85  H   UNL     1      13.558   5.157  -1.054  1.00  0.00           H  
HETATM   86  H   UNL     1      12.646   6.626  -1.478  1.00  0.00           H  
HETATM   87  H   UNL     1      10.881   5.045   1.798  1.00  0.00           H  
HETATM   88  H   UNL     1      11.793   3.577   2.223  1.00  0.00           H  
HETATM   89  H   UNL     1      13.157   5.635   2.555  1.00  0.00           H  
HETATM   90  H   UNL     1      13.857   4.577   1.306  1.00  0.00           H  
HETATM   91  H   UNL     1      14.005   8.010  -0.045  1.00  0.00           H  
HETATM   92  H   UNL     1      14.255   7.543   1.654  1.00  0.00           H  
HETATM   93  H   UNL     1      14.999   6.587   0.350  1.00  0.00           H  
HETATM   94  H   UNL     1       2.142  -0.364   0.234  1.00  0.00           H  
HETATM   95  H   UNL     1       0.936  -2.578  -1.041  1.00  0.00           H  
HETATM   96  H   UNL     1       1.113  -2.954   0.690  1.00  0.00           H  
HETATM   97  H   UNL     1      -0.116  -0.879   1.267  1.00  0.00           H  
HETATM   98  H   UNL     1      -0.293  -0.503  -0.464  1.00  0.00           H  
HETATM   99  H   UNL     1      -1.550  -2.614  -0.795  1.00  0.00           H  
HETATM  100  H   UNL     1      -1.373  -2.991   0.936  1.00  0.00           H  
HETATM  101  H   UNL     1      -2.602  -0.916   1.513  1.00  0.00           H  
HETATM  102  H   UNL     1      -2.779  -0.539  -0.218  1.00  0.00           H  
HETATM  103  H   UNL     1      -5.221  -0.735   0.904  1.00  0.00           H  
HETATM  104  H   UNL     1      -6.211  -3.271  -0.153  1.00  0.00           H  
HETATM  105  H   UNL     1      -4.431  -3.554   2.285  1.00  0.00           H  
HETATM  106  H   UNL     1      -5.493  -4.638   3.215  1.00  0.00           H  
HETATM  107  H   UNL     1      -5.276  -4.890   1.467  1.00  0.00           H  
HETATM  108  H   UNL     1      -7.486  -1.512   2.884  1.00  0.00           H  
HETATM  109  H   UNL     1      -6.784  -2.666   4.043  1.00  0.00           H  
HETATM  110  H   UNL     1      -5.722  -1.581   3.112  1.00  0.00           H  
HETATM  111  H   UNL     1      -7.709  -4.864   1.224  1.00  0.00           H  
HETATM  112  H   UNL     1      -8.029  -4.450   2.926  1.00  0.00           H  
HETATM  113  H   UNL     1      -8.654  -3.409   1.624  1.00  0.00           H  
HETATM  114  H   UNL     1      -9.402  -0.559  -1.516  1.00  0.00           H  
HETATM  115  H   UNL     1     -11.637  -2.219  -1.527  1.00  0.00           H  
HETATM  116  H   UNL     1     -10.374  -2.255  -2.799  1.00  0.00           H  
HETATM  117  H   UNL     1     -10.626  -4.045  -0.311  1.00  0.00           H  
HETATM  118  H   UNL     1      -9.958  -5.628  -2.020  1.00  0.00           H  
HETATM  119  H   UNL     1      -8.052  -3.604  -1.924  1.00  0.00           H  
HETATM  120  H   UNL     1      -8.222  -4.238  -0.259  1.00  0.00           H  
HETATM  121  H   UNL     1     -11.930  -0.001  -0.788  1.00  0.00           H  
HETATM  122  H   UNL     1     -12.700  -0.575   1.867  1.00  0.00           H  
HETATM  123  H   UNL     1     -11.748   0.929   1.872  1.00  0.00           H  
HETATM  124  H   UNL     1     -12.560   2.918   0.747  1.00  0.00           H  
HETATM  125  H   UNL     1     -14.527   4.179  -0.023  1.00  0.00           H  
HETATM  126  H   UNL     1     -16.826   0.559  -0.015  1.00  0.00           H  
HETATM  127  H   UNL     1     -14.845  -0.685   0.745  1.00  0.00           H  
HETATM  128  H   UNL     1     -19.648   5.480  -1.038  1.00  0.00           H  
HETATM  129  H   UNL     1     -18.125   0.836  -2.073  1.00  0.00           H  
HETATM  130  H   UNL     1     -17.833   1.894  -3.473  1.00  0.00           H  
HETATM  131  H   UNL     1     -16.479   1.416  -2.422  1.00  0.00           H  
HETATM  132  H   UNL     1      16.377   0.221  -1.049  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2   36    1    1    3                                       
CONECT    3    2    4    4    6                                       
CONECT    4    3    3    5   73                                       
CONECT    5    4    8    8   74                                       
CONECT    6    3    7    7   75                                       
CONECT    7    6    6    8   76                                       
CONECT    8    5    5    7    9                                       
CONECT    9    8   26   26   10                                       
CONECT   10    9   11   11   77                                       
CONECT   11   10   10   28   12                                       
CONECT   12   11   13   78                                            
CONECT   13   14   14   12   15                                       
CONECT   14   13   13                                                 
CONECT   15   13   16   25   25                                       
CONECT   16   17   15   21   21                                       
CONECT   17   20   19   18   16                                       
CONECT   18   17                                                      
CONECT   19   17                                                      
CONECT   20   17                                                      
CONECT   21   16   16   22   79                                       
CONECT   22   21   24   23   23                                       
CONECT   23   22   22                                                 
CONECT   24   25   22  132                                            
CONECT   25   15   15   24   80                                       
CONECT   26    9    9   27   81                                       
CONECT   27   26   28   28   82                                       
CONECT   28   27   27   11   29                                       
CONECT   29   28   30   32                                            
CONECT   30   29   31   83   84                                       
CONECT   31   30   34   85   86                                       
CONECT   32   29   33   87   88                                       
CONECT   33   32   34   89   90                                       
CONECT   34   33   31   35                                            
CONECT   35   34   91   92   93                                       
CONECT   36   37    2   94                                            
CONECT   37   38   36   95   96                                       
CONECT   38   39   37   97   98                                       
CONECT   39   40   38   99  100                                       
CONECT   40   39   41  101  102                                       
CONECT   41   40   42   42   43                                       
CONECT   42   41   41                                                 
CONECT   43   41   44  103                                            
CONECT   44   43   49   45  104                                       
CONECT   45   44   46   47   48                                       
CONECT   46   45  105  106  107                                       
CONECT   47   45  108  109  110                                       
CONECT   48   45  111  112  113                                       
CONECT   49   51   50   50   44                                       
CONECT   50   49   49                                                 
CONECT   51   56   49   52                                            
CONECT   52   53   51   57  114                                       
CONECT   53   54   52  115  116                                       
CONECT   54   55   56   53  117                                       
CONECT   55   54  118                                                 
CONECT   56   54   51  119  120                                       
CONECT   57   52   59   58   58                                       
CONECT   58   57   57                                                 
CONECT   59   57   60  121                                            
CONECT   60   59   61  122  123                                       
CONECT   61   62   60   66   66                                       
CONECT   62   63   63   61  124                                       
CONECT   63   62   62   64  125                                       
CONECT   64   63   67   65   65                                       
CONECT   65   64   64   66  126                                       
CONECT   66   61   61   65  127                                       
CONECT   67   68   64   71   71                                       
CONECT   68   67   69                                                 
CONECT   69   68   70   70  128                                       
CONECT   70   69   69   71                                            
CONECT   71   67   67   70   72                                       
CONECT   72   71  129  130  131                                       
CONECT   73    4                                                      
CONECT   74    5                                                      
CONECT   75    6                                                      
CONECT   76    7                                                      
CONECT   77   10                                                      
CONECT   78   12                                                      
CONECT   79   21                                                      
CONECT   80   25                                                      
CONECT   81   26                                                      
CONECT   82   27                                                      
CONECT   83   30                                                      
CONECT   84   30                                                      
CONECT   85   31                                                      
CONECT   86   31                                                      
CONECT   87   32                                                      
CONECT   88   32                                                      
CONECT   89   33                                                      
CONECT   90   33                                                      
CONECT   91   35                                                      
CONECT   92   35                                                      
CONECT   93   35                                                      
CONECT   94   36                                                      
CONECT   95   37                                                      
CONECT   96   37                                                      
CONECT   97   38                                                      
CONECT   98   38                                                      
CONECT   99   39                                                      
CONECT  100   39                                                      
CONECT  101   40                                                      
CONECT  102   40                                                      
CONECT  103   43                                                      
CONECT  104   44                                                      
CONECT  105   46                                                      
CONECT  106   46                                                      
CONECT  107   46                                                      
CONECT  108   47                                                      
CONECT  109   47                                                      
CONECT  110   47                                                      
CONECT  111   48                                                      
CONECT  112   48                                                      
CONECT  113   48                                                      
CONECT  114   52                                                      
CONECT  115   53                                                      
CONECT  116   53                                                      
CONECT  117   54                                                      
CONECT  118   55                                                      
CONECT  119   56                                                      
CONECT  120   56                                                      
CONECT  121   59                                                      
CONECT  122   60                                                      
CONECT  123   60                                                      
CONECT  124   62                                                      
CONECT  125   63                                                      
CONECT  126   65                                                      
CONECT  127   66                                                      
CONECT  128   69                                                      
CONECT  129   72                                                      
CONECT  130   72                                                      
CONECT  131   72                                                      
CONECT  132   24                                                      
MASTER        0    0    0    0    0    0    0    0  132    0  132    0
END
