COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.976  -0.329  -0.449  1.00  0.00           C  
HETATM    2  O   UNL     1      -5.728  -0.052   0.705  1.00  0.00           O  
HETATM    3  S   UNL     1      -4.719  -0.828  -1.499  1.00  0.00           S  
HETATM    4  C   UNL     1      -7.392  -0.241  -0.958  1.00  0.00           C  
HETATM    5  C   UNL     1      -8.312   0.219   0.174  1.00  0.00           C  
HETATM    6  O   UNL     1      -8.341  -0.776   1.199  1.00  0.00           O  
HETATM    7  C   UNL     1      -9.726   0.429  -0.372  1.00  0.00           C  
HETATM    8  C   UNL     1     -10.617   1.008   0.729  1.00  0.00           C  
HETATM    9  C   UNL     1     -12.031   1.217   0.183  1.00  0.00           C  
HETATM   10  C   UNL     1     -12.922   1.796   1.284  1.00  0.00           C  
HETATM   11  C   UNL     1     -14.336   2.006   0.738  1.00  0.00           C  
HETATM   12  O   UNL     1       8.769   2.190  -1.363  1.00  0.00           O  
HETATM   13  P   UNL     1       7.678   2.659  -0.478  1.00  0.00           P  
HETATM   14  O   UNL     1       6.377   2.996  -1.363  1.00  0.00           O  
HETATM   15  O   UNL     1       7.319   1.507   0.587  1.00  0.00           O  
HETATM   16  C   UNL     1       6.965   0.176   0.205  1.00  0.00           C  
HETATM   17  O   UNL     1       8.153   3.984   0.304  1.00  0.00           O  
HETATM   18  C   UNL     1       6.687  -0.658   1.457  1.00  0.00           C  
HETATM   19  C   UNL     1       7.941  -0.695   2.333  1.00  0.00           C  
HETATM   20  C   UNL     1       5.535  -0.029   2.243  1.00  0.00           C  
HETATM   21  C   UNL     1       6.307  -2.082   1.048  1.00  0.00           C  
HETATM   22  O   UNL     1       7.429  -2.714   0.428  1.00  0.00           O  
HETATM   23  C   UNL     1       5.156  -2.036   0.077  1.00  0.00           C  
HETATM   24  O   UNL     1       5.340  -2.291  -1.094  1.00  0.00           O  
HETATM   25  N   UNL     1       3.922  -1.711   0.510  1.00  0.00           N  
HETATM   26  C   UNL     1       2.783  -1.775  -0.409  1.00  0.00           C  
HETATM   27  C   UNL     1       1.508  -1.359   0.329  1.00  0.00           C  
HETATM   28  C   UNL     1       0.336  -1.425  -0.616  1.00  0.00           C  
HETATM   29  O   UNL     1       0.504  -1.771  -1.766  1.00  0.00           O  
HETATM   30  N   UNL     1      -0.898  -1.100  -0.183  1.00  0.00           N  
HETATM   31  C   UNL     1      -2.037  -1.165  -1.102  1.00  0.00           C  
HETATM   32  C   UNL     1      -3.311  -0.749  -0.364  1.00  0.00           C  
HETATM   33  H   UNL     1      -7.439   0.475  -1.778  1.00  0.00           H  
HETATM   34  H   UNL     1      -7.713  -1.220  -1.312  1.00  0.00           H  
HETATM   35  H   UNL     1      -7.940   1.156   0.587  1.00  0.00           H  
HETATM   36  H   UNL     1      -8.663  -1.638   0.902  1.00  0.00           H  
HETATM   37  H   UNL     1      -9.692   1.122  -1.213  1.00  0.00           H  
HETATM   38  H   UNL     1     -10.133  -0.526  -0.704  1.00  0.00           H  
HETATM   39  H   UNL     1     -10.652   0.315   1.570  1.00  0.00           H  
HETATM   40  H   UNL     1     -10.211   1.963   1.061  1.00  0.00           H  
HETATM   41  H   UNL     1     -11.997   1.910  -0.658  1.00  0.00           H  
HETATM   42  H   UNL     1     -12.438   0.262  -0.149  1.00  0.00           H  
HETATM   43  H   UNL     1     -12.957   1.103   2.125  1.00  0.00           H  
HETATM   44  H   UNL     1     -12.516   2.751   1.617  1.00  0.00           H  
HETATM   45  H   UNL     1     -14.302   2.698  -0.103  1.00  0.00           H  
HETATM   46  H   UNL     1     -14.743   1.050   0.406  1.00  0.00           H  
HETATM   47  H   UNL     1     -14.971   2.418   1.523  1.00  0.00           H  
HETATM   48  H   UNL     1       5.621   3.309  -0.848  1.00  0.00           H  
HETATM   49  H   UNL     1       6.072   0.203  -0.419  1.00  0.00           H  
HETATM   50  H   UNL     1       7.786  -0.272  -0.355  1.00  0.00           H  
HETATM   51  H   UNL     1       8.387   4.721  -0.277  1.00  0.00           H  
HETATM   52  H   UNL     1       8.241   0.322   2.582  1.00  0.00           H  
HETATM   53  H   UNL     1       7.727  -1.245   3.250  1.00  0.00           H  
HETATM   54  H   UNL     1       8.747  -1.191   1.793  1.00  0.00           H  
HETATM   55  H   UNL     1       4.680   0.115   1.582  1.00  0.00           H  
HETATM   56  H   UNL     1       5.252  -0.688   3.064  1.00  0.00           H  
HETATM   57  H   UNL     1       5.851   0.935   2.644  1.00  0.00           H  
HETATM   58  H   UNL     1       6.015  -2.648   1.932  1.00  0.00           H  
HETATM   59  H   UNL     1       7.744  -2.263  -0.368  1.00  0.00           H  
HETATM   60  H   UNL     1       3.788  -1.435   1.430  1.00  0.00           H  
HETATM   61  H   UNL     1       2.954  -1.100  -1.247  1.00  0.00           H  
HETATM   62  H   UNL     1       2.672  -2.794  -0.779  1.00  0.00           H  
HETATM   63  H   UNL     1       1.337  -2.034   1.168  1.00  0.00           H  
HETATM   64  H   UNL     1       1.619  -0.340   0.700  1.00  0.00           H  
HETATM   65  H   UNL     1      -1.032  -0.824   0.737  1.00  0.00           H  
HETATM   66  H   UNL     1      -1.866  -0.490  -1.940  1.00  0.00           H  
HETATM   67  H   UNL     1      -2.148  -2.184  -1.472  1.00  0.00           H  
HETATM   68  H   UNL     1      -3.201   0.270   0.007  1.00  0.00           H  
HETATM   69  H   UNL     1      -3.482  -1.424   0.475  1.00  0.00           H  
CONECT    1    2    2    3    4                                       
CONECT    2    1    1                                                 
CONECT    3    1   32                                                 
CONECT    4    1    5   33   34                                       
CONECT    5    4    6    7   35                                       
CONECT    6    5   36                                                 
CONECT    7    5    8   37   38                                       
CONECT    8    7    9   39   40                                       
CONECT    9    8   10   41   42                                       
CONECT   10    9   11   43   44                                       
CONECT   11   10   45   46   47                                       
CONECT   12   13   13                                                 
CONECT   13   12   12   14   15                                       
CONECT   13   17                                                      
CONECT   14   13   48                                                 
CONECT   15   13   16                                                 
CONECT   16   15   18   49   50                                       
CONECT   17   13   51                                                 
CONECT   18   16   19   20   21                                       
CONECT   19   18   52   53   54                                       
CONECT   20   18   55   56   57                                       
CONECT   21   18   22   23   58                                       
CONECT   22   21   59                                                 
CONECT   23   21   24   24   25                                       
CONECT   24   23   23                                                 
CONECT   25   23   26   60                                            
CONECT   26   25   27   61   62                                       
CONECT   27   26   28   63   64                                       
CONECT   28   27   29   29   30                                       
CONECT   29   28   28                                                 
CONECT   30   28   31   65                                            
CONECT   31   30   32   66   67                                       
CONECT   32    3   31   68   69                                       
CONECT   33    4                                                      
CONECT   34    4                                                      
CONECT   35    5                                                      
CONECT   36    6                                                      
CONECT   37    7                                                      
CONECT   38    7                                                      
CONECT   39    8                                                      
CONECT   40    8                                                      
CONECT   41    9                                                      
CONECT   42    9                                                      
CONECT   43   10                                                      
CONECT   44   10                                                      
CONECT   45   11                                                      
CONECT   46   11                                                      
CONECT   47   11                                                      
CONECT   48   14                                                      
CONECT   49   16                                                      
CONECT   50   16                                                      
CONECT   51   17                                                      
CONECT   52   19                                                      
CONECT   53   19                                                      
CONECT   54   19                                                      
CONECT   55   20                                                      
CONECT   56   20                                                      
CONECT   57   20                                                      
CONECT   58   21                                                      
CONECT   59   22                                                      
CONECT   60   25                                                      
CONECT   61   26                                                      
CONECT   62   26                                                      
CONECT   63   27                                                      
CONECT   64   27                                                      
CONECT   65   30                                                      
CONECT   66   31                                                      
CONECT   67   31                                                      
CONECT   68   32                                                      
CONECT   69   32                                                      
MASTER        0    0    0    0    0    0    0    0   69    0   69    0
END
