COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -5.342  -3.559   0.151  1.00  0.00           O  
HETATM    2  C   UNL     1      -6.341  -3.613  -0.870  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.418  -2.460   1.015  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.477  -1.456   0.922  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.529  -0.551  -0.136  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.533  -0.662  -1.097  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.471  -1.668  -0.998  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.416  -2.569   0.056  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.228   0.240  -0.670  1.00  0.00           C  
HETATM   10  C   UNL     1       0.715   1.261  -0.765  1.00  0.00           C  
HETATM   11  C   UNL     1       0.360   2.569  -0.426  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.921   2.849   0.002  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.860   1.840   0.096  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.518   0.531  -0.239  1.00  0.00           C  
HETATM   15  C   UNL     1       0.145  -1.172  -1.040  1.00  0.00           C  
HETATM   16  C   UNL     1       3.037   0.302  -0.316  1.00  0.00           C  
HETATM   17  C   UNL     1       4.380   0.036  -0.571  1.00  0.00           C  
HETATM   18  C   UNL     1       2.761  -0.180   0.986  1.00  0.00           C  
HETATM   19  N   UNL     1       4.879  -0.572   0.522  1.00  0.00           N  
HETATM   20  N   UNL     1       3.857  -0.693   1.469  1.00  0.00           N  
HETATM   21  O   UNL     1       5.056   0.332  -1.705  1.00  0.00           O  
HETATM   22  C   UNL     1       2.090   0.961  -1.222  1.00  0.00           C  
HETATM   23  O   UNL     1       2.434   1.260  -2.350  1.00  0.00           O  
HETATM   24  S   UNL     1      -3.494   2.209   0.644  1.00  0.00           S  
HETATM   25  O   UNL     1      -3.480   3.612   0.869  1.00  0.00           O  
HETATM   26  O   UNL     1      -4.334   1.635  -0.348  1.00  0.00           O  
HETATM   27  C   UNL     1      -3.659   1.314   2.213  1.00  0.00           C  
HETATM   28  C   UNL     1       6.260  -1.031   0.690  1.00  0.00           C  
HETATM   29  C   UNL     1       7.212   0.161   0.563  1.00  0.00           C  
HETATM   30  C   UNL     1       6.422  -1.668   2.072  1.00  0.00           C  
HETATM   31  C   UNL     1       6.590  -2.064  -0.389  1.00  0.00           C  
HETATM   32  H   UNL     1      -6.908  -2.682  -0.873  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.863  -3.750  -1.840  1.00  0.00           H  
HETATM   34  H   UNL     1      -7.015  -4.448  -0.675  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.376  -3.165   1.832  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.701  -1.372   1.668  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.575   0.038  -1.918  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.248  -1.755  -1.743  1.00  0.00           H  
HETATM   39  H   UNL     1       1.090   3.362  -0.499  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.192   3.862   0.263  1.00  0.00           H  
HETATM   41  H   UNL     1       0.441  -1.717  -0.143  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.711  -1.666  -1.500  1.00  0.00           H  
HETATM   43  H   UNL     1       0.976  -1.155  -1.745  1.00  0.00           H  
HETATM   44  H   UNL     1       1.808  -0.130   1.492  1.00  0.00           H  
HETATM   45  H   UNL     1       5.473   1.205  -1.698  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.960   1.726   2.941  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.677   1.420   2.586  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.438   0.259   2.054  1.00  0.00           H  
HETATM   49  H   UNL     1       6.978   0.897   1.332  1.00  0.00           H  
HETATM   50  H   UNL     1       8.240  -0.181   0.688  1.00  0.00           H  
HETATM   51  H   UNL     1       7.097   0.614  -0.421  1.00  0.00           H  
HETATM   52  H   UNL     1       5.743  -2.516   2.162  1.00  0.00           H  
HETATM   53  H   UNL     1       7.449  -2.009   2.197  1.00  0.00           H  
HETATM   54  H   UNL     1       6.187  -0.932   2.841  1.00  0.00           H  
HETATM   55  H   UNL     1       6.475  -1.610  -1.374  1.00  0.00           H  
HETATM   56  H   UNL     1       7.617  -2.405  -0.264  1.00  0.00           H  
HETATM   57  H   UNL     1       5.911  -2.912  -0.299  1.00  0.00           H  
CONECT    1    2    8                                                 
CONECT    2    1   32   33   34                                       
CONECT    3    4    4    8   35                                       
CONECT    4    3    3    5   36                                       
CONECT    5    4    6    6   14                                       
CONECT    6    5    5    7   37                                       
CONECT    7    6    8    8   38                                       
CONECT    8    1    3    7    7                                       
CONECT    9   10   10   14   15                                       
CONECT   10    9    9   11   22                                       
CONECT   11   10   12   12   39                                       
CONECT   12   11   11   13   40                                       
CONECT   13   12   14   14   24                                       
CONECT   14    5    9   13   13                                       
CONECT   15    9   41   42   43                                       
CONECT   16   17   17   18   22                                       
CONECT   17   16   16   19   21                                       
CONECT   18   16   20   20   44                                       
CONECT   19   17   20   28                                            
CONECT   20   18   18   19                                            
CONECT   21   17   45                                                 
CONECT   22   10   16   23   23                                       
CONECT   23   22   22                                                 
CONECT   24   13   25   25   26                                       
CONECT   24   26   27                                                 
CONECT   25   24   24                                                 
CONECT   26   24   24                                                 
CONECT   27   24   46   47   48                                       
CONECT   28   19   29   30   31                                       
CONECT   29   28   49   50   51                                       
CONECT   30   28   52   53   54                                       
CONECT   31   28   55   56   57                                       
CONECT   32    2                                                      
CONECT   33    2                                                      
CONECT   34    2                                                      
CONECT   35    3                                                      
CONECT   36    4                                                      
CONECT   37    6                                                      
CONECT   38    7                                                      
CONECT   39   11                                                      
CONECT   40   12                                                      
CONECT   41   15                                                      
CONECT   42   15                                                      
CONECT   43   15                                                      
CONECT   44   18                                                      
CONECT   45   21                                                      
CONECT   46   27                                                      
CONECT   47   27                                                      
CONECT   48   27                                                      
CONECT   49   29                                                      
CONECT   50   29                                                      
CONECT   51   29                                                      
CONECT   52   30                                                      
CONECT   53   30                                                      
CONECT   54   30                                                      
CONECT   55   31                                                      
CONECT   56   31                                                      
CONECT   57   31                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
