COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  S   UNL     1      -7.365   0.438  -0.341  1.00  0.00           S  
HETATM    2  O   UNL     1      -8.678   0.238   0.164  1.00  0.00           O  
HETATM    3  O   UNL     1      -6.925   1.726  -0.748  1.00  0.00           O  
HETATM    4  N   UNL     1      -6.375   0.051   0.930  1.00  0.00           N  
HETATM    5  C   UNL     1      -4.990   0.133   0.785  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.370   1.377   0.740  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.003   1.463   0.598  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.238   0.297   0.499  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.864  -0.952   0.545  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.232  -1.029   0.693  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.775   0.384   0.347  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.042  -0.737   0.252  1.00  0.00           C  
HETATM   13  C   UNL     1       1.421  -0.650   0.100  1.00  0.00           C  
HETATM   14  C   UNL     1       2.197  -1.819   0.075  1.00  0.00           C  
HETATM   15  C   UNL     1       3.573  -1.733  -0.069  1.00  0.00           C  
HETATM   16  C   UNL     1       4.185  -0.502  -0.189  1.00  0.00           C  
HETATM   17  C   UNL     1       3.422   0.667  -0.165  1.00  0.00           C  
HETATM   18  C   UNL     1       2.039   0.594  -0.027  1.00  0.00           C  
HETATM   19  C   UNL     1       4.084   1.986  -0.293  1.00  0.00           C  
HETATM   20  C   UNL     1       4.987   2.458   0.700  1.00  0.00           C  
HETATM   21  O   UNL     1       5.235   1.781   1.683  1.00  0.00           O  
HETATM   22  N   UNL     1       5.564   3.664   0.539  1.00  0.00           N  
HETATM   23  N   UNL     1       5.324   4.400  -0.484  1.00  0.00           N  
HETATM   24  C   UNL     1       4.510   4.042  -1.439  1.00  0.00           C  
HETATM   25  C   UNL     1       3.852   2.805  -1.390  1.00  0.00           C  
HETATM   26  C   UNL     1       4.405  -2.990  -0.094  1.00  0.00           C  
HETATM   27  C   UNL     1       5.886  -2.619  -0.188  1.00  0.00           C  
HETATM   28  C   UNL     1       4.159  -3.790   1.186  1.00  0.00           C  
HETATM   29  C   UNL     1       4.012  -3.836  -1.307  1.00  0.00           C  
HETATM   30  O   UNL     1       1.601  -3.033   0.193  1.00  0.00           O  
HETATM   31  C   UNL     1       0.927  -3.539  -0.961  1.00  0.00           C  
HETATM   32  C   UNL     1      -6.976  -0.799  -1.610  1.00  0.00           C  
HETATM   33  H   UNL     1      -6.759  -0.234   1.774  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.962   2.278   0.816  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.522   2.430   0.563  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.277  -1.855   0.469  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.716  -1.994   0.732  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.292   1.350   0.311  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.524  -1.703   0.287  1.00  0.00           H  
HETATM   40  H   UNL     1       5.257  -0.443  -0.301  1.00  0.00           H  
HETATM   41  H   UNL     1       1.446   1.497  -0.013  1.00  0.00           H  
HETATM   42  H   UNL     1       6.180   3.986   1.216  1.00  0.00           H  
HETATM   43  H   UNL     1       4.345   4.702  -2.278  1.00  0.00           H  
HETATM   44  H   UNL     1       3.181   2.501  -2.179  1.00  0.00           H  
HETATM   45  H   UNL     1       6.165  -2.016   0.676  1.00  0.00           H  
HETATM   46  H   UNL     1       6.487  -3.529  -0.207  1.00  0.00           H  
HETATM   47  H   UNL     1       6.061  -2.050  -1.101  1.00  0.00           H  
HETATM   48  H   UNL     1       3.104  -4.054   1.253  1.00  0.00           H  
HETATM   49  H   UNL     1       4.760  -4.699   1.168  1.00  0.00           H  
HETATM   50  H   UNL     1       4.438  -3.187   2.050  1.00  0.00           H  
HETATM   51  H   UNL     1       3.958  -3.201  -2.191  1.00  0.00           H  
HETATM   52  H   UNL     1       4.760  -4.614  -1.464  1.00  0.00           H  
HETATM   53  H   UNL     1       3.041  -4.297  -1.130  1.00  0.00           H  
HETATM   54  H   UNL     1       0.045  -2.931  -1.162  1.00  0.00           H  
HETATM   55  H   UNL     1       1.597  -3.503  -1.819  1.00  0.00           H  
HETATM   56  H   UNL     1       0.623  -4.570  -0.781  1.00  0.00           H  
HETATM   57  H   UNL     1      -5.894  -0.904  -1.696  1.00  0.00           H  
HETATM   58  H   UNL     1      -7.413  -1.757  -1.330  1.00  0.00           H  
HETATM   59  H   UNL     1      -7.387  -0.478  -2.567  1.00  0.00           H  
CONECT    1    2    2   32    3                                       
CONECT    1    3    4                                                 
CONECT    2    1    1                                                 
CONECT    3    1    1                                                 
CONECT    4    1    5   33                                            
CONECT    5    4    6    6   10                                       
CONECT    6    5    5    7   34                                       
CONECT    7    6    8    8   35                                       
CONECT    8    7    7    9   11                                       
CONECT    9   10   10    8   36                                       
CONECT   10    5    9    9   37                                       
CONECT   11    8   12   12   38                                       
CONECT   12   11   11   13   39                                       
CONECT   13   12   18   18   14                                       
CONECT   14   13   30   15   15                                       
CONECT   15   14   14   16   26                                       
CONECT   16   17   17   15   40                                       
CONECT   17   18   16   16   19                                       
CONECT   18   13   13   17   41                                       
CONECT   19   17   20   25   25                                       
CONECT   20   21   21   19   22                                       
CONECT   21   20   20                                                 
CONECT   22   20   23   42                                            
CONECT   23   22   24   24                                            
CONECT   24   25   23   23   43                                       
CONECT   25   19   19   24   44                                       
CONECT   26   15   29   28   27                                       
CONECT   27   26   45   46   47                                       
CONECT   28   26   48   49   50                                       
CONECT   29   26   51   52   53                                       
CONECT   30   31   14                                                 
CONECT   31   30   54   55   56                                       
CONECT   32    1   57   58   59                                       
CONECT   33    4                                                      
CONECT   34    6                                                      
CONECT   35    7                                                      
CONECT   36    9                                                      
CONECT   37   10                                                      
CONECT   38   11                                                      
CONECT   39   12                                                      
CONECT   40   16                                                      
CONECT   41   18                                                      
CONECT   42   22                                                      
CONECT   43   24                                                      
CONECT   44   25                                                      
CONECT   45   27                                                      
CONECT   46   27                                                      
CONECT   47   27                                                      
CONECT   48   28                                                      
CONECT   49   28                                                      
CONECT   50   28                                                      
CONECT   51   29                                                      
CONECT   52   29                                                      
CONECT   53   29                                                      
CONECT   54   31                                                      
CONECT   55   31                                                      
CONECT   56   31                                                      
CONECT   57   32                                                      
CONECT   58   32                                                      
CONECT   59   32                                                      
MASTER        0    0    0    0    0    0    0    0   59    0   59    0
END
