COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      15.102  20.277  30.654  1.00  0.00           C  
HETATM    2  C   UNL     1      20.386  20.819  31.426  1.00  0.00           C  
HETATM    3  C   UNL     1      15.518  19.693  35.669  1.00  0.00           C  
HETATM    4  C   UNL     1      16.032  18.552  38.344  1.00  0.00           C  
HETATM    5  C   UNL     1      16.771  18.877  35.928  1.00  0.00           C  
HETATM    6  C   UNL     1      13.955  19.021  40.574  1.00  0.00           C  
HETATM    7  C   UNL     1      13.670  18.901  32.683  1.00  0.00           C  
HETATM    8  C   UNL     1      12.983  19.423  33.630  1.00  0.00           C  
HETATM    9  C   UNL     1      13.996  20.512  34.121  1.00  0.00           C  
HETATM   10  C   UNL     1      14.136  21.302  32.808  1.00  0.00           C  
HETATM   11  C   UNL     1      12.981  18.402  31.366  1.00  0.00           C  
HETATM   12  C   UNL     1      12.673  16.549  29.656  1.00  0.00           C  
HETATM   13  C   UNL     1      15.633  21.629  30.136  1.00  0.00           C  
HETATM   14  C   UNL     1      18.013  21.322  30.925  1.00  0.00           C  
HETATM   15  C   UNL     1      14.921  21.987  28.805  1.00  0.00           C  
HETATM   16  C   UNL     1      13.371  21.964  28.965  1.00  0.00           C  
HETATM   17  C   UNL     1      14.818  19.361  38.053  1.00  0.00           C  
HETATM   18  C   UNL     1      13.787  19.643  39.174  1.00  0.00           C  
HETATM   19  C   UNL     1      15.225  18.208  40.881  1.00  0.00           C  
HETATM   20  C   UNL     1      16.239  17.939  39.760  1.00  0.00           C  
HETATM   21  C   UNL     1      11.792  19.857  41.094  1.00  0.00           C  
HETATM   22  C   UNL     1      17.785  18.666  34.780  1.00  0.00           C  
HETATM   23  C   UNL     1      11.202  16.235  29.836  1.00  0.00           C  
HETATM   24  C   UNL     1       8.433  16.654  32.911  1.00  0.00           C  
HETATM   25  C   UNL     1       8.415  15.528  33.945  1.00  0.00           C  
HETATM   26  C   UNL     1       7.092  16.057  33.390  1.00  0.00           C  
HETATM   27  C   UNL     1       8.802  18.074  33.448  1.00  0.00           C  
HETATM   28  C   UNL     1      13.077  16.816  28.194  1.00  0.00           C  
HETATM   29  C   UNL     1      12.258  17.132  26.920  1.00  0.00           C  
HETATM   30  C   UNL     1      12.115  18.402  26.446  1.00  0.00           C  
HETATM   31  C   UNL     1      12.804  19.614  27.125  1.00  0.00           C  
HETATM   32  C   UNL     1      11.911  20.885  27.102  1.00  0.00           C  
HETATM   33  C   UNL     1      13.206  15.409  28.777  1.00  0.00           C  
HETATM   34  C   UNL     1      12.715  22.128  27.567  1.00  0.00           C  
HETATM   35  C   UNL     1      21.582  20.459  30.670  1.00  0.00           C  
HETATM   36  C   UNL     1      20.097  19.881  32.577  1.00  0.00           C  
HETATM   37  C   UNL     1      20.507  21.002  33.521  1.00  0.00           C  
HETATM   38  C   UNL     1      20.619  21.982  32.371  1.00  0.00           C  
HETATM   39  F   UNL     1      21.940  21.430  29.789  1.00  0.00           F  
HETATM   40  F   UNL     1      21.215  19.367  29.938  1.00  0.00           F  
HETATM   41  F   UNL     1      22.628  20.270  31.518  1.00  0.00           F  
HETATM   42  N   UNL     1      14.396  20.252  32.022  1.00  0.00           N  
HETATM   43  N   UNL     1      13.188  16.987  30.958  1.00  0.00           N  
HETATM   44  N   UNL     1      17.037  21.530  29.835  1.00  0.00           N  
HETATM   45  N   UNL     1      14.593  19.938  36.733  1.00  0.00           N  
HETATM   46  N   UNL     1      16.994  18.324  37.253  1.00  0.00           N  
HETATM   47  N   UNL     1      10.599  16.568  31.087  1.00  0.00           N  
HETATM   48  O   UNL     1      12.387  19.140  30.638  1.00  0.00           O  
HETATM   49  O   UNL     1      15.287  19.273  30.001  1.00  0.00           O  
HETATM   50  O   UNL     1      19.321  20.982  30.503  1.00  0.00           O  
HETATM   51  O   UNL     1      17.702  21.395  32.079  1.00  0.00           O  
HETATM   52  O   UNL     1      15.291  20.211  34.396  1.00  0.00           O  
HETATM   53  O   UNL     1      12.993  19.270  41.581  1.00  0.00           O  
HETATM   54  O   UNL     1      10.593  15.610  29.056  1.00  0.00           O  
HETATM   55  O   UNL     1       8.738  14.742  31.036  1.00  0.00           O  
HETATM   56  O   UNL     1       8.278  16.888  30.151  1.00  0.00           O  
HETATM   57  S   UNL     1       8.961  16.165  31.237  1.00  0.00           S  
HETATM   58  H   UNL     1      14.449  18.192  33.002  1.00  0.00           H  
HETATM   59  H   UNL     1      12.049  19.870  33.260  1.00  0.00           H  
HETATM   60  H   UNL     1      12.752  18.692  34.419  1.00  0.00           H  
HETATM   61  H   UNL     1      13.526  21.138  34.893  1.00  0.00           H  
HETATM   62  H   UNL     1      14.965  22.024  32.836  1.00  0.00           H  
HETATM   63  H   UNL     1      13.208  21.821  32.526  1.00  0.00           H  
HETATM   64  H   UNL     1      15.440  22.414  30.881  1.00  0.00           H  
HETATM   65  H   UNL     1      15.212  21.257  28.036  1.00  0.00           H  
HETATM   66  H   UNL     1      15.233  22.994  28.492  1.00  0.00           H  
HETATM   67  H   UNL     1      13.056  22.790  29.619  1.00  0.00           H  
HETATM   68  H   UNL     1      13.060  21.006  29.408  1.00  0.00           H  
HETATM   69  H   UNL     1      12.941  20.283  38.972  1.00  0.00           H  
HETATM   70  H   UNL     1      15.402  17.830  41.877  1.00  0.00           H  
HETATM   71  H   UNL     1      17.102  17.320  39.955  1.00  0.00           H  
HETATM   72  H   UNL     1      11.097  20.020  41.931  1.00  0.00           H  
HETATM   73  H   UNL     1      12.023  20.821  40.617  1.00  0.00           H  
HETATM   74  H   UNL     1      11.328  19.185  40.357  1.00  0.00           H  
HETATM   75  H   UNL     1      18.632  18.065  35.144  1.00  0.00           H  
HETATM   76  H   UNL     1      17.293  18.140  33.948  1.00  0.00           H  
HETATM   77  H   UNL     1      18.152  19.642  34.431  1.00  0.00           H  
HETATM   78  H   UNL     1       8.763  14.522  33.667  1.00  0.00           H  
HETATM   79  H   UNL     1       8.695  15.737  34.988  1.00  0.00           H  
HETATM   80  H   UNL     1       6.423  16.649  34.032  1.00  0.00           H  
HETATM   81  H   UNL     1       6.492  15.435  32.710  1.00  0.00           H  
HETATM   82  H   UNL     1       8.406  18.196  34.467  1.00  0.00           H  
HETATM   83  H   UNL     1       9.896  18.187  33.464  1.00  0.00           H  
HETATM   84  H   UNL     1       8.364  18.840  32.791  1.00  0.00           H  
HETATM   85  H   UNL     1      14.059  17.309  28.150  1.00  0.00           H  
HETATM   86  H   UNL     1      11.784  16.320  26.389  1.00  0.00           H  
HETATM   87  H   UNL     1      11.504  18.569  25.572  1.00  0.00           H  
HETATM   88  H   UNL     1      13.025  19.355  28.171  1.00  0.00           H  
HETATM   89  H   UNL     1      13.743  19.831  26.594  1.00  0.00           H  
HETATM   90  H   UNL     1      11.547  21.052  26.077  1.00  0.00           H  
HETATM   91  H   UNL     1      11.054  20.736  27.775  1.00  0.00           H  
HETATM   92  H   UNL     1      12.527  14.611  28.441  1.00  0.00           H  
HETATM   93  H   UNL     1      14.202  14.985  28.972  1.00  0.00           H  
HETATM   94  H   UNL     1      13.510  22.322  26.832  1.00  0.00           H  
HETATM   95  H   UNL     1      12.031  22.989  27.604  1.00  0.00           H  
HETATM   96  H   UNL     1      19.044  19.573  32.663  1.00  0.00           H  
HETATM   97  H   UNL     1      20.743  18.992  32.615  1.00  0.00           H  
HETATM   98  H   UNL     1      21.459  20.818  34.041  1.00  0.00           H  
HETATM   99  H   UNL     1      19.733  21.268  34.256  1.00  0.00           H  
HETATM  100  H   UNL     1      21.605  22.460  32.273  1.00  0.00           H  
HETATM  101  H   UNL     1      19.834  22.752  32.349  1.00  0.00           H  
HETATM  102  H   UNL     1      13.668  16.347  31.559  1.00  0.00           H  
HETATM  103  H   UNL     1      17.352  21.602  28.889  1.00  0.00           H  
HETATM  104  H   UNL     1      11.110  17.010  31.825  1.00  0.00           H  
CONECT    1   49   49   13   42                                       
CONECT    2   50   35   38   36                                       
CONECT    3   52    5    5   45                                       
CONECT    4   46   46   17   20                                       
CONECT    5   22    3    3   46                                       
CONECT    6   18   18   19   53                                       
CONECT    7   11   42    8   58                                       
CONECT    8    7    9   59   60                                       
CONECT    9   10    8   52   61                                       
CONECT   10   42    9   62   63                                       
CONECT   11   48   48   43    7                                       
CONECT   12   28   33   23   43                                       
CONECT   13   15   44    1   64                                       
CONECT   14   44   50   51   51                                       
CONECT   15   16   13   65   66                                       
CONECT   16   34   15   67   68                                       
CONECT   17   45   45    4   18                                       
CONECT   18   17    6    6   69                                       
CONECT   19   20   20    6   70                                       
CONECT   20    4   19   19   71                                       
CONECT   21   53   72   73   74                                       
CONECT   22    5   75   76   77                                       
CONECT   23   54   54   12   47                                       
CONECT   24   57   26   27   25                                       
CONECT   25   24   26   78   79                                       
CONECT   26   24   25   80   81                                       
CONECT   27   24   82   83   84                                       
CONECT   28   29   33   12   85                                       
CONECT   29   30   30   28   86                                       
CONECT   30   29   29   31   87                                       
CONECT   31   30   32   88   89                                       
CONECT   32   31   34   90   91                                       
CONECT   33   28   12   92   93                                       
CONECT   34   32   16   94   95                                       
CONECT   35   39   40    2   41                                       
CONECT   36    2   37   96   97                                       
CONECT   37   38   36   98   99                                       
CONECT   38    2   37  100  101                                       
CONECT   39   35                                                      
CONECT   40   35                                                      
CONECT   41   35                                                      
CONECT   42    1    7   10                                            
CONECT   43   12   11  102                                            
CONECT   44   13   14  103                                            
CONECT   45    3   17   17                                            
CONECT   46    5    4    4                                            
CONECT   47   23   57  104                                            
CONECT   48   11   11                                                 
CONECT   49    1    1                                                 
CONECT   50   14    2                                                 
CONECT   51   14   14                                                 
CONECT   52    9    3                                                 
CONECT   53    6   21                                                 
CONECT   54   23   23                                                 
CONECT   55   57   57                                                 
CONECT   56   57   57                                                 
CONECT   57   56   56   55   55                                       
CONECT   57   47   24                                                 
CONECT   58    7                                                      
CONECT   59    8                                                      
CONECT   60    8                                                      
CONECT   61    9                                                      
CONECT   62   10                                                      
CONECT   63   10                                                      
CONECT   64   13                                                      
CONECT   65   15                                                      
CONECT   66   15                                                      
CONECT   67   16                                                      
CONECT   68   16                                                      
CONECT   69   18                                                      
CONECT   70   19                                                      
CONECT   71   20                                                      
CONECT   72   21                                                      
CONECT   73   21                                                      
CONECT   74   21                                                      
CONECT   75   22                                                      
CONECT   76   22                                                      
CONECT   77   22                                                      
CONECT   78   25                                                      
CONECT   79   25                                                      
CONECT   80   26                                                      
CONECT   81   26                                                      
CONECT   82   27                                                      
CONECT   83   27                                                      
CONECT   84   27                                                      
CONECT   85   28                                                      
CONECT   86   29                                                      
CONECT   87   30                                                      
CONECT   88   31                                                      
CONECT   89   31                                                      
CONECT   90   32                                                      
CONECT   91   32                                                      
CONECT   92   33                                                      
CONECT   93   33                                                      
CONECT   94   34                                                      
CONECT   95   34                                                      
CONECT   96   36                                                      
CONECT   97   36                                                      
CONECT   98   37                                                      
CONECT   99   37                                                      
CONECT  100   38                                                      
CONECT  101   38                                                      
CONECT  102   43                                                      
CONECT  103   44                                                      
CONECT  104   47                                                      
MASTER        0    0    0    0    0    0    0    0  104    0  104    0
END
