COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       0.445  -0.705   0.447  1.00  0.00           N  
HETATM    2  N   UNL     1       3.578  -2.724  -1.259  1.00  0.00           N  
HETATM    3  C   UNL     1       3.322   0.456   0.233  1.00  0.00           C  
HETATM    4  C   UNL     1       2.786  -0.780  -0.184  1.00  0.00           C  
HETATM    5  C   UNL     1       1.510  -1.373  -0.124  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.874  -1.339   0.500  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.939  -0.275   0.579  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.730   1.809   1.438  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.117  -0.416  -0.126  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.916   2.888  -0.242  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.959  -2.238   1.734  1.00  0.00           C  
HETATM   12  C   UNL     1       2.369  -3.236  -1.179  1.00  0.00           C  
HETATM   13  C   UNL     1       3.836  -1.508  -0.780  1.00  0.00           C  
HETATM   14  O   UNL     1      -6.005  -0.981  -0.686  1.00  0.00           O  
HETATM   15  S   UNL     1      -5.562   0.326  -1.025  1.00  0.00           S  
HETATM   16  O   UNL     1      -5.162   0.644  -2.351  1.00  0.00           O  
HETATM   17  C   UNL     1      -6.709   1.579  -0.380  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.939   2.760   0.911  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.923   1.672   0.730  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.748   0.846   1.364  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.102   0.558  -0.058  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.337  -2.900   1.790  1.00  0.00           C  
HETATM   23  C   UNL     1       0.123  -3.318   1.653  1.00  0.00           C  
HETATM   24  N   UNL     1       1.355  -2.592  -0.631  1.00  0.00           N  
HETATM   25  N   UNL     1       4.958  -0.732  -0.718  1.00  0.00           N  
HETATM   26  C   UNL     1       4.641   0.466  -0.100  1.00  0.00           C  
HETATM   27  C   UNL     1       5.577   1.568   0.155  1.00  0.00           C  
HETATM   28  O   UNL     1       5.189   2.580   0.708  1.00  0.00           O  
HETATM   29  N   UNL     1       6.866   1.459  -0.224  1.00  0.00           N  
HETATM   30  C   UNL     1       7.800   2.558   0.031  1.00  0.00           C  
HETATM   31  C   UNL     1       9.187   2.181  -0.493  1.00  0.00           C  
HETATM   32  H   UNL     1       0.572   0.183   0.817  1.00  0.00           H  
HETATM   33  H   UNL     1       2.782   1.252   0.726  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.026  -1.938  -0.398  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.572   2.685   2.049  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.273  -1.293  -0.737  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.365   3.079  -1.162  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.604   3.711  -0.050  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.807  -1.639   2.632  1.00  0.00           H  
HETATM   40  H   UNL     1       2.198  -4.225  -1.579  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.088   1.270   0.594  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.537   1.718  -1.075  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.419   3.710   1.032  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.501   2.553   1.822  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.829   0.968   1.919  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.488  -3.500   0.892  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.397  -3.541   2.669  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.107  -2.132   1.847  1.00  0.00           H  
HETATM   49  H   UNL     1       1.105  -2.846   1.614  1.00  0.00           H  
HETATM   50  H   UNL     1       0.063  -3.959   2.533  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.029  -3.917   0.756  1.00  0.00           H  
HETATM   52  H   UNL     1       5.834  -0.979  -1.053  1.00  0.00           H  
HETATM   53  H   UNL     1       7.175   0.652  -0.664  1.00  0.00           H  
HETATM   54  H   UNL     1       7.451   3.456  -0.479  1.00  0.00           H  
HETATM   55  H   UNL     1       7.856   2.747   1.103  1.00  0.00           H  
HETATM   56  H   UNL     1       9.882   2.999  -0.304  1.00  0.00           H  
HETATM   57  H   UNL     1       9.536   1.283   0.016  1.00  0.00           H  
HETATM   58  H   UNL     1       9.132   1.992  -1.565  1.00  0.00           H  
CONECT    1    5    6   32                                            
CONECT    2   12   13   13                                            
CONECT    3   26   26    4   33                                       
CONECT    4    3    5    5   13                                       
CONECT    5    4    4    1   24                                       
CONECT    6    1    7   11   34                                       
CONECT    7    6   20   20    9                                       
CONECT    8   20   19   19   35                                       
CONECT    9   21   21    7   36                                       
CONECT   10   17   18   37   38                                       
CONECT   11    6   23   22   39                                       
CONECT   12   24   24    2   40                                       
CONECT   13    2    2    4   25                                       
CONECT   14   15   15                                                 
CONECT   15   21   16   16   14                                       
CONECT   15   14   17                                                 
CONECT   16   15   15                                                 
CONECT   17   15   10   41   42                                       
CONECT   18   10   19   43   44                                       
CONECT   19    8    8   21   18                                       
CONECT   20    7    7    8   45                                       
CONECT   21   19    9    9   15                                       
CONECT   22   11   46   47   48                                       
CONECT   23   11   49   50   51                                       
CONECT   24    5   12   12                                            
CONECT   25   13   26   52                                            
CONECT   26   27    3    3   25                                       
CONECT   27   29   28   28   26                                       
CONECT   28   27   27                                                 
CONECT   29   30   27   53                                            
CONECT   30   31   29   54   55                                       
CONECT   31   30   56   57   58                                       
CONECT   32    1                                                      
CONECT   33    3                                                      
CONECT   34    6                                                      
CONECT   35    8                                                      
CONECT   36    9                                                      
CONECT   37   10                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   12                                                      
CONECT   41   17                                                      
CONECT   42   17                                                      
CONECT   43   18                                                      
CONECT   44   18                                                      
CONECT   45   20                                                      
CONECT   46   22                                                      
CONECT   47   22                                                      
CONECT   48   22                                                      
CONECT   49   23                                                      
CONECT   50   23                                                      
CONECT   51   23                                                      
CONECT   52   25                                                      
CONECT   53   29                                                      
CONECT   54   30                                                      
CONECT   55   30                                                      
CONECT   56   31                                                      
CONECT   57   31                                                      
CONECT   58   31                                                      
MASTER        0    0    0    0    0    0    0    0   58    0   58    0
END
