COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.601  -1.262   0.491  1.00  0.00           C  
HETATM    2  C   UNL     1       6.108   0.343   0.923  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.646  -2.609  -0.183  1.00  0.00           C  
HETATM    4  C   UNL     1       3.898  -0.003   0.391  1.00  0.00           C  
HETATM    5  C   UNL     1       4.185  -1.353   0.127  1.00  0.00           C  
HETATM    6  C   UNL     1       5.509  -1.794   0.291  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.425  -2.766  -1.091  1.00  0.00           C  
HETATM    8  N   UNL     1       6.425  -0.916   0.687  1.00  0.00           N  
HETATM    9  N   UNL     1      -3.999  -0.161  -0.176  1.00  0.00           N  
HETATM   10  O   UNL     1      -3.212  -1.170   1.637  1.00  0.00           O  
HETATM   11  C   UNL     1       2.067  -1.059  -0.234  1.00  0.00           C  
HETATM   12  O   UNL     1       2.880   3.258  -0.845  1.00  0.00           O  
HETATM   13  N   UNL     1       4.881   0.801   0.783  1.00  0.00           N  
HETATM   14  C   UNL     1      -1.149  -2.657  -0.254  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.471  -4.133  -1.776  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.434  -1.663  -2.152  1.00  0.00           C  
HETATM   17  N   UNL     1      -3.637  -3.667   0.836  1.00  0.00           N  
HETATM   18  S   UNL     1      -3.949   1.319   0.565  1.00  0.00           S  
HETATM   19  O   UNL     1      -4.392   2.265  -0.398  1.00  0.00           O  
HETATM   20  O   UNL     1      -4.568   1.154   1.834  1.00  0.00           O  
HETATM   21  O   UNL     1      -2.486   1.638   0.839  1.00  0.00           O  
HETATM   22  C   UNL     1      -1.749   2.026  -0.322  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.299   2.320   0.069  1.00  0.00           C  
HETATM   24  C   UNL     1       0.486   2.862  -1.146  1.00  0.00           C  
HETATM   25  O   UNL     1       0.564   4.288  -1.097  1.00  0.00           O  
HETATM   26  C   UNL     1       1.891   2.237  -0.994  1.00  0.00           C  
HETATM   27  C   UNL     1       1.788   1.392   0.295  1.00  0.00           C  
HETATM   28  O   UNL     1       0.381   1.099   0.433  1.00  0.00           O  
HETATM   29  N   UNL     1       2.556   0.152   0.155  1.00  0.00           N  
HETATM   30  N   UNL     1       3.024  -1.941  -0.250  1.00  0.00           N  
HETATM   31  N   UNL     1       5.851  -3.113   0.046  1.00  0.00           N  
HETATM   32  H   UNL     1       6.882   1.022   1.247  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.555  -2.687  -0.779  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.314  -0.235  -1.090  1.00  0.00           H  
HETATM   35  H   UNL     1       1.037  -1.259  -0.490  1.00  0.00           H  
HETATM   36  H   UNL     1       2.944   3.856  -1.603  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.142  -3.442   0.502  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.279  -2.768  -0.901  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.116  -1.682   0.234  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.380  -4.211  -2.372  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.601  -4.245  -2.423  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.464  -4.918  -1.020  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.402  -0.689  -1.665  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.564  -1.775  -2.800  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.343  -1.741  -2.749  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.804  -3.617   1.403  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.467  -3.625   1.409  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.771   1.218  -1.054  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.197   2.920  -0.756  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.267   3.035   0.891  1.00  0.00           H  
HETATM   51  H   UNL     1       0.021   2.537  -2.077  1.00  0.00           H  
HETATM   52  H   UNL     1       1.047   4.681  -1.837  1.00  0.00           H  
HETATM   53  H   UNL     1       2.123   1.604  -1.850  1.00  0.00           H  
HETATM   54  H   UNL     1       2.143   1.964   1.153  1.00  0.00           H  
HETATM   55  H   UNL     1       5.173  -3.744  -0.242  1.00  0.00           H  
HETATM   56  H   UNL     1       6.768  -3.406   0.163  1.00  0.00           H  
CONECT    1    3    9   10   10                                       
CONECT    2    8    8   13   32                                       
CONECT    3    1    7   17   33                                       
CONECT    4    5   13   13   29                                       
CONECT    5    4    6    6   30                                       
CONECT    6    5    5    8   31                                       
CONECT    7    3   14   15   16                                       
CONECT    8    2    2    6                                            
CONECT    9    1   18   34                                            
CONECT   10    1    1                                                 
CONECT   11   29   30   30   35                                       
CONECT   12   26   36                                                 
CONECT   13    2    4    4                                            
CONECT   14    7   37   38   39                                       
CONECT   15    7   40   41   42                                       
CONECT   16    7   43   44   45                                       
CONECT   17    3   46   47                                            
CONECT   18    9   19   19   20                                       
CONECT   18   20   21                                                 
CONECT   19   18   18                                                 
CONECT   20   18   18                                                 
CONECT   21   18   22                                                 
CONECT   22   21   23   48   49                                       
CONECT   23   22   24   28   50                                       
CONECT   24   23   25   26   51                                       
CONECT   25   24   52                                                 
CONECT   26   12   24   27   53                                       
CONECT   27   26   28   29   54                                       
CONECT   28   23   27                                                 
CONECT   29    4   11   27                                            
CONECT   30    5   11   11                                            
CONECT   31    6   55   56                                            
CONECT   32    2                                                      
CONECT   33    3                                                      
CONECT   34    9                                                      
CONECT   35   11                                                      
CONECT   36   12                                                      
CONECT   37   14                                                      
CONECT   38   14                                                      
CONECT   39   14                                                      
CONECT   40   15                                                      
CONECT   41   15                                                      
CONECT   42   15                                                      
CONECT   43   16                                                      
CONECT   44   16                                                      
CONECT   45   16                                                      
CONECT   46   17                                                      
CONECT   47   17                                                      
CONECT   48   22                                                      
CONECT   49   22                                                      
CONECT   50   23                                                      
CONECT   51   24                                                      
CONECT   52   25                                                      
CONECT   53   26                                                      
CONECT   54   27                                                      
CONECT   55   31                                                      
CONECT   56   31                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
