COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  S   UNL     1      -6.000   0.151  -1.832  1.00  0.00           S  
HETATM    2  O   UNL     1      -6.089   0.464  -3.215  1.00  0.00           O  
HETATM    3  O   UNL     1      -6.772  -0.900  -1.268  1.00  0.00           O  
HETATM    4  S   UNL     1      -1.706   0.685   2.611  1.00  0.00           S  
HETATM    5  O   UNL     1      -1.887   0.286   3.963  1.00  0.00           O  
HETATM    6  O   UNL     1      -1.931   2.012   2.155  1.00  0.00           O  
HETATM    7  C   UNL     1       1.072  -2.157  -0.365  1.00  0.00           C  
HETATM    8  C   UNL     1       4.363  -1.965  -0.735  1.00  0.00           C  
HETATM    9  C   UNL     1       5.703  -1.651  -0.775  1.00  0.00           C  
HETATM   10  C   UNL     1       3.455  -1.054  -0.191  1.00  0.00           C  
HETATM   11  C   UNL     1       3.911   0.178   0.311  1.00  0.00           C  
HETATM   12  N   UNL     1       2.822   0.878   0.777  1.00  0.00           N  
HETATM   13  C   UNL     1       1.669   0.136   0.599  1.00  0.00           C  
HETATM   14  C   UNL     1       2.000  -1.070   0.002  1.00  0.00           C  
HETATM   15  C   UNL     1       6.155  -0.437  -0.274  1.00  0.00           C  
HETATM   16  C   UNL     1       5.272   0.475   0.260  1.00  0.00           C  
HETATM   17  C   UNL     1       0.319   0.557   0.976  1.00  0.00           C  
HETATM   18  C   UNL     1       2.875   2.214   1.376  1.00  0.00           C  
HETATM   19  O   UNL     1      -0.390   1.125   0.165  1.00  0.00           O  
HETATM   20  C   UNL     1       0.766  -3.189   0.559  1.00  0.00           C  
HETATM   21  N   UNL     1      -0.087  -4.170   0.210  1.00  0.00           N  
HETATM   22  C   UNL     1      -0.663  -4.191  -1.018  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.400  -3.226  -1.933  1.00  0.00           C  
HETATM   24  C   UNL     1       0.478  -2.185  -1.622  1.00  0.00           C  
HETATM   25  O   UNL     1       1.275  -3.187   1.668  1.00  0.00           O  
HETATM   26  N   UNL     1      -0.140   0.316   2.220  1.00  0.00           N  
HETATM   27  C   UNL     1      -2.745  -0.357   1.641  1.00  0.00           C  
HETATM   28  C   UNL     1       2.632   3.251   0.310  1.00  0.00           C  
HETATM   29  C   UNL     1       3.671   3.698  -0.496  1.00  0.00           C  
HETATM   30  C   UNL     1       3.415   4.649  -1.463  1.00  0.00           C  
HETATM   31  N   UNL     1       2.200   5.136  -1.629  1.00  0.00           N  
HETATM   32  C   UNL     1       1.184   4.736  -0.880  1.00  0.00           C  
HETATM   33  C   UNL     1       1.368   3.776   0.110  1.00  0.00           C  
HETATM   34  N   UNL     1      -0.080   5.276  -1.089  1.00  0.00           N  
HETATM   35 CL   UNL     1       6.834  -2.779  -1.456  1.00  0.00          Cl  
HETATM   36  C   UNL     1      -3.131  -1.592   2.127  1.00  0.00           C  
HETATM   37  C   UNL     1      -3.946  -2.413   1.370  1.00  0.00           C  
HETATM   38  C   UNL     1      -4.378  -2.000   0.125  1.00  0.00           C  
HETATM   39  C   UNL     1      -3.993  -0.760  -0.367  1.00  0.00           C  
HETATM   40  C   UNL     1      -3.178   0.064   0.399  1.00  0.00           C  
HETATM   41  N   UNL     1      -4.431  -0.337  -1.624  1.00  0.00           N  
HETATM   42  C   UNL     1      -6.143   1.655  -0.828  1.00  0.00           C  
HETATM   43  H   UNL     1       4.015  -2.910  -1.125  1.00  0.00           H  
HETATM   44  H   UNL     1       7.208  -0.202  -0.310  1.00  0.00           H  
HETATM   45  H   UNL     1       5.634   1.417   0.642  1.00  0.00           H  
HETATM   46  H   UNL     1       2.109   2.298   2.146  1.00  0.00           H  
HETATM   47  H   UNL     1       3.857   2.373   1.821  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.344  -4.991  -1.271  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.870  -3.262  -2.905  1.00  0.00           H  
HETATM   50  H   UNL     1       0.688  -1.410  -2.344  1.00  0.00           H  
HETATM   51  H   UNL     1       0.448  -0.073   2.886  1.00  0.00           H  
HETATM   52  H   UNL     1       4.669   3.306  -0.367  1.00  0.00           H  
HETATM   53  H   UNL     1       4.220   5.000  -2.092  1.00  0.00           H  
HETATM   54  H   UNL     1       0.537   3.448   0.716  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.215   5.943  -1.781  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.828   4.986  -0.544  1.00  0.00           H  
HETATM   57  H   UNL     1      -2.794  -1.917   3.101  1.00  0.00           H  
HETATM   58  H   UNL     1      -4.246  -3.378   1.752  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.015  -2.642  -0.466  1.00  0.00           H  
HETATM   60  H   UNL     1      -2.876   1.030   0.020  1.00  0.00           H  
HETATM   61  H   UNL     1      -3.818  -0.330  -2.375  1.00  0.00           H  
HETATM   62  H   UNL     1      -7.142   2.076  -0.944  1.00  0.00           H  
HETATM   63  H   UNL     1      -5.972   1.410   0.220  1.00  0.00           H  
HETATM   64  H   UNL     1      -5.402   2.383  -1.157  1.00  0.00           H  
HETATM   65  H   UNL     1      -0.292  -4.874   0.846  1.00  0.00           H  
CONECT    1   42    3    3    2                                       
CONECT    1    2   41                                                 
CONECT    2    1    1                                                 
CONECT    3    1    1                                                 
CONECT    4    6    6   27    5                                       
CONECT    4    5   26                                                 
CONECT    5    4    4                                                 
CONECT    6    4    4                                                 
CONECT    7   20   14   24   24                                       
CONECT    8   10   10    9   43                                       
CONECT    9   15   15    8   35                                       
CONECT   10   14   11    8    8                                       
CONECT   11   12   16   16   10                                       
CONECT   12   18   13   11                                            
CONECT   13   17   12   14   14                                       
CONECT   14   13   13    7   10                                       
CONECT   15   16    9    9   44                                       
CONECT   16   11   11   15   45                                       
CONECT   17   26   19   19   13                                       
CONECT   18   28   12   46   47                                       
CONECT   19   17   17                                                 
CONECT   20   25   25   21    7                                       
CONECT   21   20   22   65                                            
CONECT   22   21   23   23   48                                       
CONECT   23   22   22   24   49                                       
CONECT   24    7    7   23   50                                       
CONECT   25   20   20                                                 
CONECT   26    4   17   51                                            
CONECT   27   40    4   36   36                                       
CONECT   28   29   18   33   33                                       
CONECT   29   30   30   28   52                                       
CONECT   30   29   29   31   53                                       
CONECT   31   30   32   32                                            
CONECT   32   31   31   33   34                                       
CONECT   33   28   28   32   54                                       
CONECT   34   32   55   56                                            
CONECT   35    9                                                      
CONECT   36   27   27   37   57                                       
CONECT   37   38   38   36   58                                       
CONECT   38   39   37   37   59                                       
CONECT   39   41   40   40   38                                       
CONECT   40   39   39   27   60                                       
CONECT   41    1   39   61                                            
CONECT   42    1   62   63   64                                       
CONECT   43    8                                                      
CONECT   44   15                                                      
CONECT   45   16                                                      
CONECT   46   18                                                      
CONECT   47   18                                                      
CONECT   48   22                                                      
CONECT   49   23                                                      
CONECT   50   24                                                      
CONECT   51   26                                                      
CONECT   52   29                                                      
CONECT   53   30                                                      
CONECT   54   33                                                      
CONECT   55   34                                                      
CONECT   56   34                                                      
CONECT   57   36                                                      
CONECT   58   37                                                      
CONECT   59   38                                                      
CONECT   60   40                                                      
CONECT   61   41                                                      
CONECT   62   42                                                      
CONECT   63   42                                                      
CONECT   64   42                                                      
CONECT   65   21                                                      
MASTER        0    0    0    0    0    0    0    0   65    0   65    0
END
