COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       1.835  -0.854  -0.869  1.00  0.00           N  
HETATM    2  C   UNL     1       3.985  -1.648  -0.007  1.00  0.00           C  
HETATM    3  C   UNL     1       4.726  -2.682   0.566  1.00  0.00           C  
HETATM    4  C   UNL     1       4.101  -4.039   0.760  1.00  0.00           C  
HETATM    5  C   UNL     1       6.033  -2.463   0.953  1.00  0.00           C  
HETATM    6  C   UNL     1       6.611  -1.220   0.777  1.00  0.00           C  
HETATM    7  C   UNL     1       5.881  -0.183   0.207  1.00  0.00           C  
HETATM    8  C   UNL     1       7.858   1.294   0.448  1.00  0.00           C  
HETATM    9  C   UNL     1       8.542   2.466  -0.279  1.00  0.00           C  
HETATM   10  C   UNL     1       7.995   2.137   1.729  1.00  0.00           C  
HETATM   11  C   UNL     1       4.569  -0.393  -0.186  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.339   0.187  -1.148  1.00  0.00           C  
HETATM   13  C   UNL     1       0.435  -1.535  -2.756  1.00  0.00           C  
HETATM   14  C   UNL     1       0.452  -1.087  -1.293  1.00  0.00           C  
HETATM   15  C   UNL     1       2.587  -1.882  -0.429  1.00  0.00           C  
HETATM   16  N   UNL     1       6.471   1.072   0.032  1.00  0.00           N  
HETATM   17  N   UNL     1       9.111   2.822   1.040  1.00  0.00           N  
HETATM   18  O   UNL     1       2.117  -3.002  -0.378  1.00  0.00           O  
HETATM   19  C   UNL     1       0.233   1.398  -1.496  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.489   2.572  -1.371  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.785   2.542  -0.900  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.368   1.323  -0.548  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.757   1.283  -0.042  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.558   2.355   0.117  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.816   2.068   0.605  1.00  0.00           C  
HETATM   26  C   UNL     1      -6.048   0.774   0.846  1.00  0.00           C  
HETATM   27  C   UNL     1      -7.339   0.209   1.380  1.00  0.00           C  
HETATM   28  N   UNL     1      -8.222  -0.131   0.262  1.00  0.00           N  
HETATM   29  C   UNL     1      -9.441  -0.655   0.501  1.00  0.00           C  
HETATM   30  C   UNL     1     -10.350  -1.005  -0.649  1.00  0.00           C  
HETATM   31  O   UNL     1      -9.805  -0.846   1.642  1.00  0.00           O  
HETATM   32  S   UNL     1      -4.622  -0.171   0.438  1.00  0.00           S  
HETATM   33  C   UNL     1      -1.635   0.143  -0.675  1.00  0.00           C  
HETATM   34  H   UNL     1       2.210   0.039  -0.910  1.00  0.00           H  
HETATM   35  H   UNL     1       4.172  -4.608  -0.167  1.00  0.00           H  
HETATM   36  H   UNL     1       4.625  -4.571   1.554  1.00  0.00           H  
HETATM   37  H   UNL     1       3.052  -3.920   1.034  1.00  0.00           H  
HETATM   38  H   UNL     1       6.605  -3.264   1.396  1.00  0.00           H  
HETATM   39  H   UNL     1       7.634  -1.054   1.083  1.00  0.00           H  
HETATM   40  H   UNL     1       8.450   0.379   0.459  1.00  0.00           H  
HETATM   41  H   UNL     1       9.288   2.154  -1.010  1.00  0.00           H  
HETATM   42  H   UNL     1       7.845   3.206  -0.672  1.00  0.00           H  
HETATM   43  H   UNL     1       7.138   2.782   1.924  1.00  0.00           H  
HETATM   44  H   UNL     1       8.303   1.562   2.602  1.00  0.00           H  
HETATM   45  H   UNL     1       4.000   0.411  -0.629  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.594  -1.709  -3.071  1.00  0.00           H  
HETATM   47  H   UNL     1       0.880  -0.759  -3.378  1.00  0.00           H  
HETATM   48  H   UNL     1       1.008  -2.457  -2.860  1.00  0.00           H  
HETATM   49  H   UNL     1       0.007  -1.864  -0.670  1.00  0.00           H  
HETATM   50  H   UNL     1       5.962   1.795  -0.366  1.00  0.00           H  
HETATM   51  H   UNL     1       9.074   3.818   1.193  1.00  0.00           H  
HETATM   52  H   UNL     1       1.247   1.427  -1.865  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.036   3.514  -1.643  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.347   3.459  -0.802  1.00  0.00           H  
HETATM   55  H   UNL     1      -4.241   3.360  -0.119  1.00  0.00           H  
HETATM   56  H   UNL     1      -6.558   2.832   0.781  1.00  0.00           H  
HETATM   57  H   UNL     1      -7.129  -0.688   1.962  1.00  0.00           H  
HETATM   58  H   UNL     1      -7.824   0.950   2.015  1.00  0.00           H  
HETATM   59  H   UNL     1      -7.931   0.022  -0.651  1.00  0.00           H  
HETATM   60  H   UNL     1      -9.854  -0.764  -1.590  1.00  0.00           H  
HETATM   61  H   UNL     1     -10.578  -2.070  -0.621  1.00  0.00           H  
HETATM   62  H   UNL     1     -11.274  -0.432  -0.568  1.00  0.00           H  
HETATM   63  H   UNL     1      -2.082  -0.803  -0.409  1.00  0.00           H  
CONECT    1   14   15   34                                            
CONECT    2   15    3    3   11                                       
CONECT    3    4    2    2    5                                       
CONECT    4    3   35   36   37                                       
CONECT    5    3    6    6   38                                       
CONECT    6    5    5    7   39                                       
CONECT    7   11   11    6   16                                       
CONECT    8   10    9   16   40                                       
CONECT    9   17    8   41   42                                       
CONECT   10   17    8   43   44                                       
CONECT   11    2    7    7   45                                       
CONECT   12   14   19   19   33                                       
CONECT   13   14   46   47   48                                       
CONECT   14   13    1   12   49                                       
CONECT   15    1    2   18   18                                       
CONECT   16    7    8   50                                            
CONECT   17   10    9   51                                            
CONECT   18   15   15                                                 
CONECT   19   12   12   20   52                                       
CONECT   20   19   21   21   53                                       
CONECT   21   20   20   22   54                                       
CONECT   22   33   33   21   23                                       
CONECT   23   22   32   24   24                                       
CONECT   24   23   23   25   55                                       
CONECT   25   24   26   26   56                                       
CONECT   26   32   25   25   27                                       
CONECT   27   26   28   57   58                                       
CONECT   28   27   29   59                                            
CONECT   29   28   31   31   30                                       
CONECT   30   29   60   61   62                                       
CONECT   31   29   29                                                 
CONECT   32   23   26                                                 
CONECT   33   12   22   22   63                                       
CONECT   34    1                                                      
CONECT   35    4                                                      
CONECT   36    4                                                      
CONECT   37    4                                                      
CONECT   38    5                                                      
CONECT   39    6                                                      
CONECT   40    8                                                      
CONECT   41    9                                                      
CONECT   42    9                                                      
CONECT   43   10                                                      
CONECT   44   10                                                      
CONECT   45   11                                                      
CONECT   46   13                                                      
CONECT   47   13                                                      
CONECT   48   13                                                      
CONECT   49   14                                                      
CONECT   50   16                                                      
CONECT   51   17                                                      
CONECT   52   19                                                      
CONECT   53   20                                                      
CONECT   54   21                                                      
CONECT   55   24                                                      
CONECT   56   25                                                      
CONECT   57   27                                                      
CONECT   58   27                                                      
CONECT   59   28                                                      
CONECT   60   30                                                      
CONECT   61   30                                                      
CONECT   62   30                                                      
CONECT   63   33                                                      
MASTER        0    0    0    0    0    0    0    0   63    0   63    0
END
