COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       1.737  -0.551   0.998  1.00  0.00           N  
HETATM    2  C   UNL     1       0.219   1.285   1.664  1.00  0.00           C  
HETATM    3  C   UNL     1       0.475  -0.131   1.215  1.00  0.00           C  
HETATM    4  C   UNL     1       1.984  -1.891   0.694  1.00  0.00           C  
HETATM    5  C   UNL     1       1.042  -2.862   0.963  1.00  0.00           C  
HETATM    6  C   UNL     1       2.372  -4.566   0.132  1.00  0.00           C  
HETATM    7  C   UNL     1       4.601  -4.077  -0.777  1.00  0.00           C  
HETATM    8  C   UNL     1       4.211  -1.364  -0.215  1.00  0.00           C  
HETATM    9  C   UNL     1       0.764   2.241   0.637  1.00  0.00           C  
HETATM   10  C   UNL     1       2.536   3.608  -0.211  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.038   2.624  -0.440  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.417   2.101  -0.530  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.410  -1.770   0.558  1.00  0.00           C  
HETATM   14  O   UNL     1      -2.052   2.217  -1.560  1.00  0.00           O  
HETATM   15  N   UNL     1      -1.962   1.493   0.541  1.00  0.00           N  
HETATM   16  S   UNL     1      -3.425   0.731   0.390  1.00  0.00           S  
HETATM   17  O   UNL     1      -3.975   0.765   1.699  1.00  0.00           O  
HETATM   18  O   UNL     1      -4.060   1.402  -0.690  1.00  0.00           O  
HETATM   19  C   UNL     1      -3.001  -0.970  -0.079  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.275  -1.724  -0.467  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.581  -3.025   0.278  1.00  0.00           C  
HETATM   22  O   UNL     1      -4.636  -1.653  -1.848  1.00  0.00           O  
HETATM   23  C   UNL     1      -3.526  -1.733  -2.744  1.00  0.00           C  
HETATM   24  C   UNL     1       0.462   3.494  -1.407  1.00  0.00           C  
HETATM   25  C   UNL     1       1.747   3.982  -1.286  1.00  0.00           C  
HETATM   26 CL   UNL     1       4.148   4.233  -0.064  1.00  0.00          Cl  
HETATM   27  C   UNL     1       2.044   2.737   0.749  1.00  0.00           C  
HETATM   28  C   UNL     1      -1.283   1.497   1.835  1.00  0.00           C  
HETATM   29  O   UNL     1      -0.455  -0.892   1.049  1.00  0.00           O  
HETATM   30  C   UNL     1       3.203  -2.284   0.097  1.00  0.00           C  
HETATM   31  C   UNL     1       5.366  -1.804  -0.791  1.00  0.00           C  
HETATM   32  C   UNL     1       5.560  -3.155  -1.068  1.00  0.00           C  
HETATM   33  C   UNL     1       3.396  -3.660  -0.189  1.00  0.00           C  
HETATM   34  N   UNL     1       1.260  -4.138   0.681  1.00  0.00           N  
HETATM   35  H   UNL     1       2.473   0.078   1.050  1.00  0.00           H  
HETATM   36  H   UNL     1       0.718   1.455   2.618  1.00  0.00           H  
HETATM   37  H   UNL     1       0.104  -2.575   1.416  1.00  0.00           H  
HETATM   38  H   UNL     1       2.500  -5.619  -0.075  1.00  0.00           H  
HETATM   39  H   UNL     1       4.765  -5.122  -0.998  1.00  0.00           H  
HETATM   40  H   UNL     1       4.075  -0.314  -0.002  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.249  -1.263   1.510  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.431  -1.746   0.179  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.316  -0.954  -0.926  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.525  -1.471   0.764  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.875  -3.344   1.044  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.057  -3.827  -0.286  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.890  -1.803  -3.769  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.909  -0.840  -2.638  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.931  -2.615  -2.508  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.153   3.785  -2.246  1.00  0.00           H  
HETATM   51  H   UNL     1       2.139   4.657  -2.033  1.00  0.00           H  
HETATM   52  H   UNL     1       2.664   2.449   1.585  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.690   0.698   2.455  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.456   2.454   2.327  1.00  0.00           H  
HETATM   55  H   UNL     1       6.143  -1.094  -1.032  1.00  0.00           H  
HETATM   56  H   UNL     1       6.486  -3.477  -1.520  1.00  0.00           H  
CONECT    1    4    3   35                                            
CONECT    2    3   28    9   36                                       
CONECT    3    1    2   29   29                                       
CONECT    4   30   30    5    1                                       
CONECT    5   34   34    4   37                                       
CONECT    6   33   33   34   38                                       
CONECT    7   32   32   33   39                                       
CONECT    8   31   31   30   40                                       
CONECT    9    2   27   27   11                                       
CONECT   10   27   26   25   25                                       
CONECT   11    9   12   24   24                                       
CONECT   12   15   11   14   14                                       
CONECT   13   21   20   41   42                                       
CONECT   14   12   12                                                 
CONECT   15   28   16   12                                            
CONECT   16   17   17   19   15                                       
CONECT   16   18   18                                                 
CONECT   17   16   16                                                 
CONECT   18   16   16                                                 
CONECT   19   16   20   43   44                                       
CONECT   20   13   21   19   22                                       
CONECT   21   13   20   45   46                                       
CONECT   22   20   23                                                 
CONECT   23   22   47   48   49                                       
CONECT   24   11   11   25   50                                       
CONECT   25   10   10   24   51                                       
CONECT   26   10                                                      
CONECT   27    9    9   10   52                                       
CONECT   28    2   15   53   54                                       
CONECT   29    3    3                                                 
CONECT   30   33    8    4    4                                       
CONECT   31   32    8    8   55                                       
CONECT   32    7    7   31   56                                       
CONECT   33    7    6    6   30                                       
CONECT   34    6    5    5                                            
CONECT   35    1                                                      
CONECT   36    2                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39    7                                                      
CONECT   40    8                                                      
CONECT   41   13                                                      
CONECT   42   13                                                      
CONECT   43   19                                                      
CONECT   44   19                                                      
CONECT   45   21                                                      
CONECT   46   21                                                      
CONECT   47   23                                                      
CONECT   48   23                                                      
CONECT   49   23                                                      
CONECT   50   24                                                      
CONECT   51   25                                                      
CONECT   52   27                                                      
CONECT   53   28                                                      
CONECT   54   28                                                      
CONECT   55   31                                                      
CONECT   56   32                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
