COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.416  -4.540   0.201  1.00  0.00           C  
HETATM    2  N   UNL     1      -1.532  -3.888   0.983  1.00  0.00           N  
HETATM    3  O   UNL     1      -2.904  -5.592   0.571  1.00  0.00           O  
HETATM    4  S   UNL     1       0.439   3.473  -0.781  1.00  0.00           S  
HETATM    5  C   UNL     1      -2.775  -3.987  -1.052  1.00  0.00           C  
HETATM    6  N   UNL     1      -1.322  -2.191  -0.618  1.00  0.00           N  
HETATM    7  O   UNL     1      -0.194  -2.150   1.287  1.00  0.00           O  
HETATM    8  C   UNL     1      -2.219  -2.819  -1.438  1.00  0.00           C  
HETATM    9  O   UNL     1       0.717  -0.968  -0.880  1.00  0.00           O  
HETATM   10  C   UNL     1      -0.993  -2.724   0.573  1.00  0.00           C  
HETATM   11  O   UNL     1      -0.364   2.233  -1.221  1.00  0.00           O  
HETATM   12  C   UNL     1      -3.765  -4.693  -1.942  1.00  0.00           C  
HETATM   13  O   UNL     1      -2.391   0.796  -0.516  1.00  0.00           O  
HETATM   14  C   UNL     1      -0.718  -0.924  -1.037  1.00  0.00           C  
HETATM   15  O   UNL     1       3.482  -0.215  -0.429  1.00  0.00           O  
HETATM   16  C   UNL     1       1.173   0.393  -0.806  1.00  0.00           C  
HETATM   17  O   UNL     1       1.718   3.390  -1.394  1.00  0.00           O  
HETATM   18  C   UNL     1       0.007   1.236  -0.262  1.00  0.00           C  
HETATM   19  O   UNL     1      -0.424   4.597  -0.890  1.00  0.00           O  
HETATM   20  C   UNL     1      -1.151   0.226  -0.092  1.00  0.00           C  
HETATM   21  C   UNL     1       2.374   0.489   0.137  1.00  0.00           C  
HETATM   22  C   UNL     1       0.366   1.837   1.062  1.00  0.00           C  
HETATM   23  C   UNL     1       0.655   3.129   0.948  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.012   1.801   0.011  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.943  -0.716   1.344  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.761   1.997   2.048  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.041   1.958   1.132  1.00  0.00           C  
HETATM   28  C   UNL     1      -5.609   0.952  -1.113  1.00  0.00           C  
HETATM   29  C   UNL     1      -4.638   3.180  -0.535  1.00  0.00           C  
HETATM   30  C   UNL     1       6.185  -1.133  -0.361  1.00  0.00           C  
HETATM   31  C   UNL     1       5.368   1.583   0.740  1.00  0.00           C  
HETATM   32  C   UNL     1       4.469  -0.961   2.145  1.00  0.00           C  
HETATM   33  C   UNL     1       7.448  -1.103   0.502  1.00  0.00           C  
HETATM   34  C   UNL     1       6.480  -0.494  -1.719  1.00  0.00           C  
HETATM   35  C   UNL     1       5.742  -2.583  -0.566  1.00  0.00           C  
HETATM   36 SI   UNL     1      -3.488   0.963   0.679  1.00  0.00          Si  
HETATM   37 SI   UNL     1       4.828  -0.183   0.491  1.00  0.00          Si  
HETATM   38  H   UNL     1      -1.284  -4.258   1.844  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.477  -2.385  -2.393  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.098  -5.612  -1.459  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.623  -4.044  -2.118  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.291  -4.934  -2.894  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.984  -0.697  -2.069  1.00  0.00           H  
HETATM   44  H   UNL     1       1.453   0.745  -1.799  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.217  -0.121   0.939  1.00  0.00           H  
HETATM   46  H   UNL     1       2.117   0.048   1.099  1.00  0.00           H  
HETATM   47  H   UNL     1       2.643   1.536   0.277  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.421  -1.301   0.558  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.043  -1.229   1.683  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.632  -0.601   2.181  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.510   2.148   2.826  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.897   1.485   2.471  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.451   2.963   1.649  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.615   2.563   1.933  1.00  0.00           H  
HETATM   55  H   UNL     1      -6.932   2.448   0.741  1.00  0.00           H  
HETATM   56  H   UNL     1      -6.307   0.975   1.521  1.00  0.00           H  
HETATM   57  H   UNL     1      -5.875  -0.031  -0.724  1.00  0.00           H  
HETATM   58  H   UNL     1      -6.500   1.442  -1.505  1.00  0.00           H  
HETATM   59  H   UNL     1      -4.876   0.840  -1.912  1.00  0.00           H  
HETATM   60  H   UNL     1      -3.905   3.068  -1.334  1.00  0.00           H  
HETATM   61  H   UNL     1      -5.529   3.670  -0.926  1.00  0.00           H  
HETATM   62  H   UNL     1      -4.213   3.785   0.266  1.00  0.00           H  
HETATM   63  H   UNL     1       5.579   2.039  -0.228  1.00  0.00           H  
HETATM   64  H   UNL     1       4.574   2.139   1.238  1.00  0.00           H  
HETATM   65  H   UNL     1       6.268   1.604   1.355  1.00  0.00           H  
HETATM   66  H   UNL     1       5.369  -0.940   2.760  1.00  0.00           H  
HETATM   67  H   UNL     1       3.675  -0.405   2.643  1.00  0.00           H  
HETATM   68  H   UNL     1       4.153  -1.994   1.999  1.00  0.00           H  
HETATM   69  H   UNL     1       7.238  -1.558   1.470  1.00  0.00           H  
HETATM   70  H   UNL     1       8.242  -1.659   0.004  1.00  0.00           H  
HETATM   71  H   UNL     1       7.764  -0.070   0.648  1.00  0.00           H  
HETATM   72  H   UNL     1       6.796   0.539  -1.574  1.00  0.00           H  
HETATM   73  H   UNL     1       7.274  -1.050  -2.218  1.00  0.00           H  
HETATM   74  H   UNL     1       5.581  -0.515  -2.334  1.00  0.00           H  
HETATM   75  H   UNL     1       4.842  -2.604  -1.180  1.00  0.00           H  
HETATM   76  H   UNL     1       6.536  -3.139  -1.064  1.00  0.00           H  
HETATM   77  H   UNL     1       5.531  -3.038   0.402  1.00  0.00           H  
HETATM   78  N   UNL     1       0.394   1.133   2.260  1.00  0.00           N  
HETATM   79  H   UNL     1       0.172   0.189   2.272  1.00  0.00           H  
HETATM   80  H   UNL     1       0.636   1.585   3.083  1.00  0.00           H  
HETATM   81  H   UNL     1       0.953   3.813   1.729  1.00  0.00           H  
CONECT    1    3    3    2    5                                       
CONECT    2    1   38   10                                            
CONECT    3    1    1                                                 
CONECT    4   17   17   11   19                                       
CONECT    4   19   23                                                 
CONECT    5    1   12    8    8                                       
CONECT    6    8   10   14                                            
CONECT    7   10   10                                                 
CONECT    8    6    5    5   39                                       
CONECT    9   14   16                                                 
CONECT   10    6    7    7    2                                       
CONECT   11    4   18                                                 
CONECT   12    5   40   41   42                                       
CONECT   13   20   36                                                 
CONECT   14    6    9   43   20                                       
CONECT   15   21   37                                                 
CONECT   16    9   44   18   21                                       
CONECT   17    4    4                                                 
CONECT   18   11   16   20   22                                       
CONECT   19    4    4                                                 
CONECT   20   13   18   14   45                                       
CONECT   21   15   16   46   47                                       
CONECT   22   18   23   23   78                                       
CONECT   23    4   22   22   81                                       
CONECT   24   36   29   27   28                                       
CONECT   25   48   49   50   36                                       
CONECT   26   36   51   52   53                                       
CONECT   27   24   54   55   56                                       
CONECT   28   24   57   58   59                                       
CONECT   29   24   60   61   62                                       
CONECT   30   37   33   34   35                                       
CONECT   31   37   63   64   65                                       
CONECT   32   66   67   68   37                                       
CONECT   33   30   69   70   71                                       
CONECT   34   30   72   73   74                                       
CONECT   35   30   75   76   77                                       
CONECT   36   24   26   13   25                                       
CONECT   37   30   31   15   32                                       
CONECT   38    2                                                      
CONECT   39    8                                                      
CONECT   40   12                                                      
CONECT   41   12                                                      
CONECT   42   12                                                      
CONECT   43   14                                                      
CONECT   44   16                                                      
CONECT   45   20                                                      
CONECT   46   21                                                      
CONECT   47   21                                                      
CONECT   48   25                                                      
CONECT   49   25                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
CONECT   52   26                                                      
CONECT   53   26                                                      
CONECT   54   27                                                      
CONECT   55   27                                                      
CONECT   56   27                                                      
CONECT   57   28                                                      
CONECT   58   28                                                      
CONECT   59   28                                                      
CONECT   60   29                                                      
CONECT   61   29                                                      
CONECT   62   29                                                      
CONECT   63   31                                                      
CONECT   64   31                                                      
CONECT   65   31                                                      
CONECT   66   32                                                      
CONECT   67   32                                                      
CONECT   68   32                                                      
CONECT   69   33                                                      
CONECT   70   33                                                      
CONECT   71   33                                                      
CONECT   72   34                                                      
CONECT   73   34                                                      
CONECT   74   34                                                      
CONECT   75   35                                                      
CONECT   76   35                                                      
CONECT   77   35                                                      
CONECT   78   22   79   80                                            
CONECT   79   78                                                      
CONECT   80   78                                                      
CONECT   81   23                                                      
MASTER        0    0    0    0    0    0    0    0   81    0   81    0
END
