COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.265   2.013  -0.268  1.00  0.00           C  
HETATM    2  C   UNL     1      -7.540   1.812  -0.168  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.897   0.781  -0.127  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.707  -2.007   0.180  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.250  -3.429   0.339  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.596  -5.713   0.806  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.283   0.717  -0.094  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.392  -6.633   1.019  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.579  -6.711  -0.276  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.147  -5.300  -0.684  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.387  -4.419  -0.848  1.00  0.00           C  
HETATM   12  C   UNL     1      -6.035   1.882  -0.203  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.783   2.087  -0.309  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.987   3.055   0.318  1.00  0.00           C  
HETATM   15  C   UNL     1       0.311   2.774   0.037  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.405   3.104  -0.343  1.00  0.00           C  
HETATM   17  C   UNL     1       1.463   3.608   0.542  1.00  0.00           C  
HETATM   18  C   UNL     1       0.895   4.949   1.028  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.421   4.222   1.168  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.026   3.175  -0.375  1.00  0.00           C  
HETATM   21  C   UNL     1       1.546   1.028  -1.260  1.00  0.00           C  
HETATM   22  C   UNL     1       2.040  -0.022  -0.262  1.00  0.00           C  
HETATM   23  C   UNL     1       3.364  -0.609  -0.754  1.00  0.00           C  
HETATM   24  C   UNL     1       4.880  -2.448  -0.327  1.00  0.00           C  
HETATM   25  C   UNL     1       6.068  -1.650  -0.871  1.00  0.00           C  
HETATM   26  C   UNL     1       6.707  -0.854   0.270  1.00  0.00           C  
HETATM   27  C   UNL     1       5.652   0.062   0.897  1.00  0.00           C  
HETATM   28  C   UNL     1       4.476  -0.786   1.389  1.00  0.00           C  
HETATM   29  C   UNL     1       7.841  -0.021  -0.271  1.00  0.00           C  
HETATM   30  C   UNL     1       9.130  -0.212   0.205  1.00  0.00           C  
HETATM   31  C   UNL     1      10.172   0.556  -0.295  1.00  0.00           C  
HETATM   32  C   UNL     1       9.923   1.509  -1.264  1.00  0.00           C  
HETATM   33  C   UNL     1       8.637   1.696  -1.736  1.00  0.00           C  
HETATM   34  C   UNL     1       7.598   0.928  -1.244  1.00  0.00           C  
HETATM   35  C   UNL     1      10.724  -1.290   1.601  1.00  0.00           C  
HETATM   36  F   UNL     1      -7.952   1.254   1.047  1.00  0.00           F  
HETATM   37  F   UNL     1      -8.069   3.101  -0.293  1.00  0.00           F  
HETATM   38  F   UNL     1      -7.994   1.016  -1.225  1.00  0.00           F  
HETATM   39  N   UNL     1      -4.129  -4.375   0.418  1.00  0.00           N  
HETATM   40  N   UNL     1       0.343   1.675  -0.732  1.00  0.00           N  
HETATM   41  N   UNL     1      -0.979   1.251  -0.938  1.00  0.00           N  
HETATM   42  N   UNL     1      -0.250   4.708   1.917  1.00  0.00           N  
HETATM   43  N   UNL     1       3.899  -1.527   0.261  1.00  0.00           N  
HETATM   44  O   UNL     1       1.069  -1.064  -0.148  1.00  0.00           O  
HETATM   45  O   UNL     1       9.373  -1.149   1.159  1.00  0.00           O  
HETATM   46  S   UNL     1      -6.091  -0.839   0.083  1.00  0.00           S  
HETATM   47  H   UNL     1      -3.312  -0.122  -0.043  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.081  -1.760   1.038  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.113  -1.945  -0.732  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.843  -3.491   1.251  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.875  -3.677  -0.519  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.228  -6.120   0.017  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.168  -5.643   1.731  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.766  -6.234   1.817  1.00  0.00           H  
HETATM   55  H   UNL     1      -3.739  -7.629   1.292  1.00  0.00           H  
HETATM   56  H   UNL     1      -1.697  -7.331  -0.116  1.00  0.00           H  
HETATM   57  H   UNL     1      -3.193  -7.146  -1.065  1.00  0.00           H  
HETATM   58  H   UNL     1      -1.501  -4.880   0.087  1.00  0.00           H  
HETATM   59  H   UNL     1      -1.604  -5.345  -1.629  1.00  0.00           H  
HETATM   60  H   UNL     1      -3.081  -3.410  -1.125  1.00  0.00           H  
HETATM   61  H   UNL     1      -4.025  -4.832  -1.630  1.00  0.00           H  
HETATM   62  H   UNL     1      -5.992   4.006  -0.428  1.00  0.00           H  
HETATM   63  H   UNL     1       1.955   3.095   1.368  1.00  0.00           H  
HETATM   64  H   UNL     1       2.176   3.779  -0.264  1.00  0.00           H  
HETATM   65  H   UNL     1       1.667   5.495   1.570  1.00  0.00           H  
HETATM   66  H   UNL     1       0.569   5.538   0.170  1.00  0.00           H  
HETATM   67  H   UNL     1      -1.806   5.018   0.531  1.00  0.00           H  
HETATM   68  H   UNL     1      -2.195   3.902   1.865  1.00  0.00           H  
HETATM   69  H   UNL     1      -3.538   4.132  -0.489  1.00  0.00           H  
HETATM   70  H   UNL     1       2.323   1.777  -1.414  1.00  0.00           H  
HETATM   71  H   UNL     1       1.313   0.546  -2.209  1.00  0.00           H  
HETATM   72  H   UNL     1       2.188   0.444   0.712  1.00  0.00           H  
HETATM   73  H   UNL     1       3.198  -1.153  -1.684  1.00  0.00           H  
HETATM   74  H   UNL     1       4.077   0.197  -0.927  1.00  0.00           H  
HETATM   75  H   UNL     1       4.414  -3.005  -1.140  1.00  0.00           H  
HETATM   76  H   UNL     1       5.229  -3.143   0.437  1.00  0.00           H  
HETATM   77  H   UNL     1       6.803  -2.335  -1.293  1.00  0.00           H  
HETATM   78  H   UNL     1       5.722  -0.965  -1.645  1.00  0.00           H  
HETATM   79  H   UNL     1       7.088  -1.541   1.025  1.00  0.00           H  
HETATM   80  H   UNL     1       6.090   0.600   1.737  1.00  0.00           H  
HETATM   81  H   UNL     1       5.299   0.774   0.151  1.00  0.00           H  
HETATM   82  H   UNL     1       4.827  -1.489   2.145  1.00  0.00           H  
HETATM   83  H   UNL     1       3.717  -0.135   1.823  1.00  0.00           H  
HETATM   84  H   UNL     1      11.176   0.410   0.074  1.00  0.00           H  
HETATM   85  H   UNL     1      10.733   2.107  -1.653  1.00  0.00           H  
HETATM   86  H   UNL     1       8.445   2.442  -2.494  1.00  0.00           H  
HETATM   87  H   UNL     1       6.595   1.074  -1.618  1.00  0.00           H  
HETATM   88  H   UNL     1      10.778  -2.070   2.361  1.00  0.00           H  
HETATM   89  H   UNL     1      11.356  -1.562   0.756  1.00  0.00           H  
HETATM   90  H   UNL     1      11.069  -0.347   2.023  1.00  0.00           H  
HETATM   91  H   UNL     1      -0.477   5.536   2.447  1.00  0.00           H  
HETATM   92  H   UNL     1       0.887  -1.524  -0.979  1.00  0.00           H  
CONECT    1    3    3   20   13                                       
CONECT    2   38   36   12   37                                       
CONECT    3    7    1    1   47                                       
CONECT    4    5   46   48   49                                       
CONECT    5   39    4   50   51                                       
CONECT    6    8   39   52   53                                       
CONECT    7   46   12   12    3                                       
CONECT    8    9    6   54   55                                       
CONECT    9    8   10   56   57                                       
CONECT   10    9   11   58   59                                       
CONECT   11   10   39   60   61                                       
CONECT   12    2    7    7   16                                       
CONECT   13    1   14   41   41                                       
CONECT   14   19   13   15   15                                       
CONECT   15   14   14   17   40                                       
CONECT   16   12   20   20   62                                       
CONECT   17   18   15   63   64                                       
CONECT   18   42   17   65   66                                       
CONECT   19   42   14   67   68                                       
CONECT   20   16   16    1   69                                       
CONECT   21   40   22   70   71                                       
CONECT   22   44   23   21   72                                       
CONECT   23   43   22   73   74                                       
CONECT   24   43   25   75   76                                       
CONECT   25   26   24   77   78                                       
CONECT   26   27   29   25   79                                       
CONECT   27   28   26   80   81                                       
CONECT   28   27   43   82   83                                       
CONECT   29   30   26   34   34                                       
CONECT   30   45   31   31   29                                       
CONECT   31   30   30   32   84                                       
CONECT   32   31   33   33   85                                       
CONECT   33   32   32   34   86                                       
CONECT   34   29   29   33   87                                       
CONECT   35   45   88   89   90                                       
CONECT   36    2                                                      
CONECT   37    2                                                      
CONECT   38    2                                                      
CONECT   39    6   11    5                                            
CONECT   40   15   41   21                                            
CONECT   41   13   13   40                                            
CONECT   42   19   18   91                                            
CONECT   43   28   24   23                                            
CONECT   44   22   92                                                 
CONECT   45   35   30                                                 
CONECT   46    4    7                                                 
CONECT   47    3                                                      
CONECT   48    4                                                      
CONECT   49    4                                                      
CONECT   50    5                                                      
CONECT   51    5                                                      
CONECT   52    6                                                      
CONECT   53    6                                                      
CONECT   54    8                                                      
CONECT   55    8                                                      
CONECT   56    9                                                      
CONECT   57    9                                                      
CONECT   58   10                                                      
CONECT   59   10                                                      
CONECT   60   11                                                      
CONECT   61   11                                                      
CONECT   62   16                                                      
CONECT   63   17                                                      
CONECT   64   17                                                      
CONECT   65   18                                                      
CONECT   66   18                                                      
CONECT   67   19                                                      
CONECT   68   19                                                      
CONECT   69   20                                                      
CONECT   70   21                                                      
CONECT   71   21                                                      
CONECT   72   22                                                      
CONECT   73   23                                                      
CONECT   74   23                                                      
CONECT   75   24                                                      
CONECT   76   24                                                      
CONECT   77   25                                                      
CONECT   78   25                                                      
CONECT   79   26                                                      
CONECT   80   27                                                      
CONECT   81   27                                                      
CONECT   82   28                                                      
CONECT   83   28                                                      
CONECT   84   31                                                      
CONECT   85   32                                                      
CONECT   86   33                                                      
CONECT   87   34                                                      
CONECT   88   35                                                      
CONECT   89   35                                                      
CONECT   90   35                                                      
CONECT   91   42                                                      
CONECT   92   44                                                      
MASTER        0    0    0    0    0    0    0    0   92    0   92    0
END
