COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.966   3.657  -3.237  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.549   4.914  -3.081  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.165   4.306  -1.757  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.776   3.353  -2.576  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.953   4.921  -0.759  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.179   2.791  -0.020  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.240   2.272   1.431  1.00  0.00           C  
HETATM    8  N   UNL     1       0.820   1.256   1.495  1.00  0.00           N  
HETATM    9  C   UNL     1       0.871   0.646   0.165  1.00  0.00           C  
HETATM   10  C   UNL     1       0.857   1.886  -0.737  1.00  0.00           C  
HETATM   11  C   UNL     1       0.654   1.673  -2.224  1.00  0.00           C  
HETATM   12  C   UNL     1       0.474   2.568  -4.462  1.00  0.00           C  
HETATM   13  C   UNL     1       0.276   0.189  -4.094  1.00  0.00           C  
HETATM   14  C   UNL     1       0.462   0.385  -2.726  1.00  0.00           C  
HETATM   15  C   UNL     1       0.091   1.079  -6.364  1.00  0.00           C  
HETATM   16 CL   UNL     1      -5.716   2.480  -4.244  1.00  0.00          Cl  
HETATM   17  C   UNL     1      -4.942   5.869  -2.265  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.752   5.565  -1.604  1.00  0.00           C  
HETATM   19  N   UNL     1      -1.945   3.995  -1.079  1.00  0.00           N  
HETATM   20  N   UNL     1       0.078   4.216  -0.119  1.00  0.00           N  
HETATM   21  C   UNL     1       0.660   2.765  -3.094  1.00  0.00           C  
HETATM   22  C   UNL     1       0.282   1.280  -4.962  1.00  0.00           C  
HETATM   23  N   UNL     1      -0.064   0.916  -7.504  1.00  0.00           N  
HETATM   24  C   UNL     1       0.596   0.280   2.550  1.00  0.00           C  
HETATM   25  C   UNL     1       0.546   0.921   3.907  1.00  0.00           C  
HETATM   26  S   UNL     1       1.991   1.086   4.790  1.00  0.00           S  
HETATM   27  C   UNL     1       1.155   1.832   6.085  1.00  0.00           C  
HETATM   28  C   UNL     1      -0.194   1.944   5.833  1.00  0.00           C  
HETATM   29  C   UNL     1      -0.547   1.411   4.560  1.00  0.00           C  
HETATM   30  C   UNL     1      -1.109   2.539   6.771  1.00  0.00           C  
HETATM   31  O   UNL     1      -0.813   3.007   7.885  1.00  0.00           O  
HETATM   32  O   UNL     1      -2.401   2.553   6.324  1.00  0.00           O  
HETATM   33  C   UNL     1      -1.578   2.725  -0.655  1.00  0.00           C  
HETATM   34  O   UNL     1      -2.220   1.682  -0.716  1.00  0.00           O  
HETATM   35  C   UNL     1       1.314   4.834   0.335  1.00  0.00           C  
HETATM   36  O   UNL     1      -0.919   6.120  -1.011  1.00  0.00           O  
HETATM   37 CL   UNL     1      -5.661   7.420  -2.073  1.00  0.00          Cl  
HETATM   38  H   UNL     1      -6.477   5.151  -3.597  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.320   2.373  -2.696  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.045   3.058   2.168  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.219   1.832   1.662  1.00  0.00           H  
HETATM   42  H   UNL     1       0.005  -0.001  -0.030  1.00  0.00           H  
HETATM   43  H   UNL     1       1.784   0.059   0.021  1.00  0.00           H  
HETATM   44  H   UNL     1       1.848   2.356  -0.661  1.00  0.00           H  
HETATM   45  H   UNL     1       0.481   3.429  -5.127  1.00  0.00           H  
HETATM   46  H   UNL     1       0.127  -0.821  -4.469  1.00  0.00           H  
HETATM   47  H   UNL     1       0.455  -0.471  -2.056  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.277   6.308  -0.966  1.00  0.00           H  
HETATM   49  H   UNL     1       0.809   3.771  -2.713  1.00  0.00           H  
HETATM   50  H   UNL     1       1.402  -0.460   2.502  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.340  -0.244   2.328  1.00  0.00           H  
HETATM   52  H   UNL     1       1.697   2.150   6.966  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.552   1.394   4.156  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.033   2.957   6.957  1.00  0.00           H  
HETATM   55  H   UNL     1       1.163   5.305   1.310  1.00  0.00           H  
HETATM   56  H   UNL     1       1.639   5.597  -0.378  1.00  0.00           H  
HETATM   57  H   UNL     1       2.101   4.081   0.426  1.00  0.00           H  
CONECT    1   16    4    4    2                                       
CONECT    2    1   17   17   38                                       
CONECT    3    4   19   18   18                                       
CONECT    4    1    1    3   39                                       
CONECT    5   19   20   36   36                                       
CONECT    6   10    7   33   20                                       
CONECT    7    6    8   40   41                                       
CONECT    8    7   24    9                                            
CONECT    9    8   10   42   43                                       
CONECT   10    6    9   11   44                                       
CONECT   11   10   14   21   21                                       
CONECT   12   22   22   21   45                                       
CONECT   13   14   14   22   46                                       
CONECT   14   11   13   13   47                                       
CONECT   15   23   23   23   22                                       
CONECT   16    1                                                      
CONECT   17    2    2   18   37                                       
CONECT   18    3    3   17   48                                       
CONECT   19    3    5   33                                            
CONECT   20    5    6   35                                            
CONECT   21   11   11   12   49                                       
CONECT   22   12   12   13   15                                       
CONECT   23   15   15   15                                            
CONECT   24    8   25   50   51                                       
CONECT   25   24   29   29   26                                       
CONECT   26   25   27                                                 
CONECT   27   26   28   28   52                                       
CONECT   28   27   27   30   29                                       
CONECT   29   25   25   28   53                                       
CONECT   30   28   31   31   32                                       
CONECT   31   30   30                                                 
CONECT   32   30   54                                                 
CONECT   33    6   19   34   34                                       
CONECT   34   33   33                                                 
CONECT   35   20   55   56   57                                       
CONECT   36    5    5                                                 
CONECT   37   17                                                      
CONECT   38    2                                                      
CONECT   39    4                                                      
CONECT   40    7                                                      
CONECT   41    7                                                      
CONECT   42    9                                                      
CONECT   43    9                                                      
CONECT   44   10                                                      
CONECT   45   12                                                      
CONECT   46   13                                                      
CONECT   47   14                                                      
CONECT   48   18                                                      
CONECT   49   21                                                      
CONECT   50   24                                                      
CONECT   51   24                                                      
CONECT   52   27                                                      
CONECT   53   29                                                      
CONECT   54   32                                                      
CONECT   55   35                                                      
CONECT   56   35                                                      
CONECT   57   35                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
