COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -1.987   1.130   0.362  1.00  0.00           N  
HETATM    2  N   UNL     1       4.188  -1.990  -2.319  1.00  0.00           N  
HETATM    3  C   UNL     1       0.806  -0.036  -0.093  1.00  0.00           C  
HETATM    4  C   UNL     1       0.375   1.018   0.897  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.032   0.726   1.408  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.033   2.552   0.004  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.630   3.088  -0.138  1.00  0.00           C  
HETATM    8  C   UNL     1       0.786   4.891  -0.853  1.00  0.00           C  
HETATM    9  C   UNL     1       0.474   2.379   0.285  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.472  -0.988   0.039  1.00  0.00           C  
HETATM   11  C   UNL     1      -6.854  -1.077   0.689  1.00  0.00           C  
HETATM   12  C   UNL     1       3.527  -1.077  -1.623  1.00  0.00           C  
HETATM   13  C   UNL     1       4.149  -3.270  -2.033  1.00  0.00           C  
HETATM   14  C   UNL     1       3.384  -3.728  -0.949  1.00  0.00           C  
HETATM   15  C   UNL     1       2.559  -5.478   0.454  1.00  0.00           C  
HETATM   16  C   UNL     1       1.892  -3.219   0.910  1.00  0.00           C  
HETATM   17  N   UNL     1      -5.291  -1.591  -2.492  1.00  0.00           N  
HETATM   18  C   UNL     1      -5.370  -1.328  -1.389  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.787  -2.124   1.015  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.533   0.119   0.523  1.00  0.00           C  
HETATM   21  S   UNL     1      -2.966   0.022  -0.384  1.00  0.00           S  
HETATM   22  O   UNL     1      -3.122   0.525  -1.704  1.00  0.00           O  
HETATM   23  O   UNL     1      -2.328  -1.225  -0.147  1.00  0.00           O  
HETATM   24  C   UNL     1       1.739   2.933   0.136  1.00  0.00           C  
HETATM   25  C   UNL     1       1.896   4.182  -0.430  1.00  0.00           C  
HETATM   26 CL   UNL     1       3.484   4.862  -0.609  1.00  0.00          Cl  
HETATM   27  C   UNL     1      -0.469   4.340  -0.714  1.00  0.00           C  
HETATM   28  C   UNL     1       1.386   0.897   2.056  1.00  0.00           C  
HETATM   29  C   UNL     1       0.855  -0.028   3.153  1.00  0.00           C  
HETATM   30  C   UNL     1       1.825  -0.025   4.336  1.00  0.00           C  
HETATM   31  O   UNL     1       0.124  -0.454  -1.005  1.00  0.00           O  
HETATM   32  N   UNL     1       2.057  -0.444   0.184  1.00  0.00           N  
HETATM   33  C   UNL     1       2.606   0.270   1.344  1.00  0.00           C  
HETATM   34  C   UNL     1       2.747  -1.420  -0.539  1.00  0.00           C  
HETATM   35  C   UNL     1       2.661  -2.783  -0.177  1.00  0.00           C  
HETATM   36  C   UNL     1       1.849  -4.547   1.211  1.00  0.00           C  
HETATM   37  C   UNL     1       3.315  -5.089  -0.609  1.00  0.00           C  
HETATM   38  H   UNL     1      -1.219   1.296   2.318  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.137  -0.340   1.611  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.563   2.671  -0.941  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.555   3.106   0.784  1.00  0.00           H  
HETATM   42  H   UNL     1       0.904   5.867  -1.299  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.095  -0.346   1.462  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.688  -1.386   0.059  1.00  0.00           H  
HETATM   45  H   UNL     1       3.601  -0.038  -1.911  1.00  0.00           H  
HETATM   46  H   UNL     1       4.707  -3.973  -2.634  1.00  0.00           H  
HETATM   47  H   UNL     1       2.507  -6.525   0.715  1.00  0.00           H  
HETATM   48  H   UNL     1       1.338  -2.508   1.504  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.919  -3.123   0.599  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.326  -2.082   2.002  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.996   1.090   0.347  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.344  -0.005   1.589  1.00  0.00           H  
HETATM   53  H   UNL     1       2.607   2.381   0.466  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.335   4.891  -1.049  1.00  0.00           H  
HETATM   55  H   UNL     1       1.634   1.878   2.462  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.122   0.323   3.483  1.00  0.00           H  
HETATM   57  H   UNL     1       0.764  -1.041   2.761  1.00  0.00           H  
HETATM   58  H   UNL     1       2.803  -0.377   4.006  1.00  0.00           H  
HETATM   59  H   UNL     1       1.917   0.988   4.728  1.00  0.00           H  
HETATM   60  H   UNL     1       1.447  -0.685   5.118  1.00  0.00           H  
HETATM   61  H   UNL     1       3.294   1.049   1.016  1.00  0.00           H  
HETATM   62  H   UNL     1       3.114  -0.428   2.010  1.00  0.00           H  
HETATM   63  H   UNL     1       1.257  -4.884   2.049  1.00  0.00           H  
HETATM   64  H   UNL     1       3.859  -5.822  -1.187  1.00  0.00           H  
CONECT    1    5   21    6                                            
CONECT    2   13   12   12                                            
CONECT    3   32    4   31   31                                       
CONECT    4   28    3    5    9                                       
CONECT    5    4    1   38   39                                       
CONECT    6    1    7   40   41                                       
CONECT    7    9    6   27   27                                       
CONECT    8   25   25   27   42                                       
CONECT    9    4   24   24    7                                       
CONECT   10   19   11   20   18                                       
CONECT   11   19   10   43   44                                       
CONECT   12    2    2   34   45                                       
CONECT   13   14   14    2   46                                       
CONECT   14   37   13   13   35                                       
CONECT   15   37   37   36   47                                       
CONECT   16   36   36   35   48                                       
CONECT   17   18   18   18                                            
CONECT   18   10   17   17   17                                       
CONECT   19   11   10   49   50                                       
CONECT   20   10   21   51   52                                       
CONECT   21   22   22   20    1                                       
CONECT   21   23   23                                                 
CONECT   22   21   21                                                 
CONECT   23   21   21                                                 
CONECT   24    9    9   25   53                                       
CONECT   25   24   26    8    8                                       
CONECT   26   25                                                      
CONECT   27    7    7    8   54                                       
CONECT   28   33   29    4   55                                       
CONECT   29   28   30   56   57                                       
CONECT   30   29   58   59   60                                       
CONECT   31    3    3                                                 
CONECT   32   34   33    3                                            
CONECT   33   32   28   61   62                                       
CONECT   34   35   35   12   32                                       
CONECT   35   14   16   34   34                                       
CONECT   36   15   16   16   63                                       
CONECT   37   15   15   14   64                                       
CONECT   38    5                                                      
CONECT   39    5                                                      
CONECT   40    6                                                      
CONECT   41    6                                                      
CONECT   42    8                                                      
CONECT   43   11                                                      
CONECT   44   11                                                      
CONECT   45   12                                                      
CONECT   46   13                                                      
CONECT   47   15                                                      
CONECT   48   16                                                      
CONECT   49   19                                                      
CONECT   50   19                                                      
CONECT   51   20                                                      
CONECT   52   20                                                      
CONECT   53   24                                                      
CONECT   54   27                                                      
CONECT   55   28                                                      
CONECT   56   29                                                      
CONECT   57   29                                                      
CONECT   58   30                                                      
CONECT   59   30                                                      
CONECT   60   30                                                      
CONECT   61   33                                                      
CONECT   62   33                                                      
CONECT   63   36                                                      
CONECT   64   37                                                      
MASTER        0    0    0    0    0    0    0    0   64    0   64    0
END
