COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       2.336   1.312  -3.641  1.00  0.00           O  
HETATM    2 CL   UNL     1       2.457   6.927   1.555  1.00  0.00          Cl  
HETATM    3 CL   UNL     1       4.811   1.160  -7.701  1.00  0.00          Cl  
HETATM    4  C   UNL     1       4.295   8.741   0.779  1.00  0.00           C  
HETATM    5  C   UNL     1       5.417   9.169   0.067  1.00  0.00           C  
HETATM    6  C   UNL     1       3.841   7.435   0.666  1.00  0.00           C  
HETATM    7  C   UNL     1       6.083   8.252  -0.770  1.00  0.00           C  
HETATM    8  C   UNL     1       4.504   6.527  -0.164  1.00  0.00           C  
HETATM    9  C   UNL     1       5.645   6.930  -0.900  1.00  0.00           C  
HETATM   10  S   UNL     1       7.478   8.549  -1.738  1.00  0.00           S  
HETATM   11  C   UNL     1       7.504   6.949  -2.324  1.00  0.00           C  
HETATM   12  C   UNL     1       6.483   6.209  -1.800  1.00  0.00           C  
HETATM   13  C   UNL     1       6.273   4.764  -2.150  1.00  0.00           C  
HETATM   14  N   UNL     1       5.399   4.604  -3.313  1.00  0.00           N  
HETATM   15  C   UNL     1       5.231   3.220  -3.663  1.00  0.00           C  
HETATM   16  C   UNL     1       4.343   3.045  -4.884  1.00  0.00           C  
HETATM   17  C   UNL     1       3.491   1.459  -6.519  1.00  0.00           C  
HETATM   18  N   UNL     1       4.153   1.641  -5.230  1.00  0.00           N  
HETATM   19  C   UNL     1       2.501   0.293  -6.567  1.00  0.00           C  
HETATM   20  C   UNL     1       3.587   0.861  -4.133  1.00  0.00           C  
HETATM   21  N   UNL     1       2.952  -0.858  -5.781  1.00  0.00           N  
HETATM   22  C   UNL     1       3.451  -0.580  -4.616  1.00  0.00           C  
HETATM   23  N   UNL     1       3.878  -1.556  -3.750  1.00  0.00           N  
HETATM   24  C   UNL     1       3.791  -2.938  -4.117  1.00  0.00           C  
HETATM   25  C   UNL     1       4.295  -3.864  -3.016  1.00  0.00           C  
HETATM   26  C   UNL     1       4.053  -4.672  -0.644  1.00  0.00           C  
HETATM   27  C   UNL     1       3.494  -3.733  -1.722  1.00  0.00           C  
HETATM   28  C   UNL     1       3.216  -4.613   0.630  1.00  0.00           C  
HETATM   29  N   UNL     1       2.084  -4.038  -1.996  1.00  0.00           N  
HETATM   30  C   UNL     1       1.743  -4.846   0.314  1.00  0.00           C  
HETATM   31  C   UNL     1       1.260  -3.913  -0.794  1.00  0.00           C  
HETATM   32  H   UNL     1       2.172   0.834  -2.812  1.00  0.00           H  
HETATM   33  H   UNL     1       3.783   9.452   1.423  1.00  0.00           H  
HETATM   34  H   UNL     1       5.765  10.193   0.161  1.00  0.00           H  
HETATM   35  H   UNL     1       4.146   5.503  -0.249  1.00  0.00           H  
HETATM   36  H   UNL     1       8.268   6.638  -3.024  1.00  0.00           H  
HETATM   37  H   UNL     1       7.228   4.279  -2.377  1.00  0.00           H  
HETATM   38  H   UNL     1       5.822   4.219  -1.315  1.00  0.00           H  
HETATM   39  H   UNL     1       4.490   5.027  -3.094  1.00  0.00           H  
HETATM   40  H   UNL     1       4.785   2.721  -2.797  1.00  0.00           H  
HETATM   41  H   UNL     1       6.227   2.799  -3.831  1.00  0.00           H  
HETATM   42  H   UNL     1       4.768   3.544  -5.761  1.00  0.00           H  
HETATM   43  H   UNL     1       3.351   3.465  -4.691  1.00  0.00           H  
HETATM   44  H   UNL     1       2.977   2.367  -6.854  1.00  0.00           H  
HETATM   45  H   UNL     1       1.526   0.615  -6.177  1.00  0.00           H  
HETATM   46  H   UNL     1       2.323  -0.030  -7.599  1.00  0.00           H  
HETATM   47  H   UNL     1       4.288   0.875  -3.290  1.00  0.00           H  
HETATM   48  H   UNL     1       4.240  -1.247  -2.883  1.00  0.00           H  
HETATM   49  H   UNL     1       4.395  -3.068  -5.020  1.00  0.00           H  
HETATM   50  H   UNL     1       2.748  -3.153  -4.370  1.00  0.00           H  
HETATM   51  H   UNL     1       4.227  -4.900  -3.366  1.00  0.00           H  
HETATM   52  H   UNL     1       5.352  -3.660  -2.807  1.00  0.00           H  
HETATM   53  H   UNL     1       5.090  -4.400  -0.413  1.00  0.00           H  
HETATM   54  H   UNL     1       4.072  -5.704  -1.018  1.00  0.00           H  
HETATM   55  H   UNL     1       3.578  -2.693  -1.384  1.00  0.00           H  
HETATM   56  H   UNL     1       3.338  -3.631   1.104  1.00  0.00           H  
HETATM   57  H   UNL     1       3.569  -5.363   1.346  1.00  0.00           H  
HETATM   58  H   UNL     1       1.596  -5.890   0.007  1.00  0.00           H  
HETATM   59  H   UNL     1       1.142  -4.691   1.217  1.00  0.00           H  
HETATM   60  H   UNL     1       0.222  -4.155  -1.049  1.00  0.00           H  
HETATM   61  H   UNL     1       1.263  -2.873  -0.446  1.00  0.00           H  
HETATM   62  H   UNL     1       2.011  -4.992  -2.353  1.00  0.00           H  
CONECT    1   20   32                                                 
CONECT    2    6                                                      
CONECT    3   17                                                      
CONECT    4    5    6    6   33                                       
CONECT    5    4    7    7   34                                       
CONECT    6    2    4    4    8                                       
CONECT    7    5    5    9   10                                       
CONECT    8    6    9    9   35                                       
CONECT    9    7    8    8   12                                       
CONECT   10    7   11                                                 
CONECT   11   10   12   12   36                                       
CONECT   12    9   11   11   13                                       
CONECT   13   12   14   37   38                                       
CONECT   14   13   15   39                                            
CONECT   15   14   16   40   41                                       
CONECT   16   15   18   42   43                                       
CONECT   17    3   18   19   44                                       
CONECT   18   16   17   20                                            
CONECT   19   17   21   45   46                                       
CONECT   20    1   18   22   47                                       
CONECT   21   19   22   22                                            
CONECT   22   20   21   21   23                                       
CONECT   23   22   24   48                                            
CONECT   24   23   25   49   50                                       
CONECT   25   24   27   51   52                                       
CONECT   26   27   28   53   54                                       
CONECT   27   25   26   29   55                                       
CONECT   28   26   30   56   57                                       
CONECT   29   27   31   62                                            
CONECT   30   28   31   58   59                                       
CONECT   31   29   30   60   61                                       
CONECT   32    1                                                      
CONECT   33    4                                                      
CONECT   34    5                                                      
CONECT   35    8                                                      
CONECT   36   11                                                      
CONECT   37   13                                                      
CONECT   38   13                                                      
CONECT   39   14                                                      
CONECT   40   15                                                      
CONECT   41   15                                                      
CONECT   42   16                                                      
CONECT   43   16                                                      
CONECT   44   17                                                      
CONECT   45   19                                                      
CONECT   46   19                                                      
CONECT   47   20                                                      
CONECT   48   23                                                      
CONECT   49   24                                                      
CONECT   50   24                                                      
CONECT   51   25                                                      
CONECT   52   25                                                      
CONECT   53   26                                                      
CONECT   54   26                                                      
CONECT   55   27                                                      
CONECT   56   28                                                      
CONECT   57   28                                                      
CONECT   58   30                                                      
CONECT   59   30                                                      
CONECT   60   31                                                      
CONECT   61   31                                                      
CONECT   62   29                                                      
MASTER        0    0    0    0    0    0    0    0   62    0   62    0
END
