COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.342   1.106  -1.910  1.00  0.00           C  
HETATM    2  C   UNL     1       5.200   1.071  -0.514  1.00  0.00           C  
HETATM    3  C   UNL     1       4.620  -0.067   0.098  1.00  0.00           C  
HETATM    4  C   UNL     1       4.198  -1.140  -0.705  1.00  0.00           C  
HETATM    5  C   UNL     1       4.351  -1.072  -2.056  1.00  0.00           C  
HETATM    6  C   UNL     1       4.922   0.047  -2.657  1.00  0.00           C  
HETATM    7  C   UNL     1       5.625   2.149   0.293  1.00  0.00           C  
HETATM    8  C   UNL     1       5.468   2.074   1.660  1.00  0.00           C  
HETATM    9  C   UNL     1       4.896   0.950   2.250  1.00  0.00           C  
HETATM   10  C   UNL     1       4.478  -0.104   1.496  1.00  0.00           C  
HETATM   11  N   UNL     1       6.199   3.278  -0.288  1.00  0.00           N  
HETATM   12  C   UNL     1       5.415   4.482   0.017  1.00  0.00           C  
HETATM   13  C   UNL     1       7.596   3.437   0.139  1.00  0.00           C  
HETATM   14  S   UNL     1       3.474  -2.567   0.033  1.00  0.00           S  
HETATM   15  O   UNL     1       3.108  -3.430  -1.035  1.00  0.00           O  
HETATM   16  O   UNL     1       4.343  -2.960   1.086  1.00  0.00           O  
HETATM   17  N   UNL     1       2.060  -2.085   0.749  1.00  0.00           N  
HETATM   18  C   UNL     1       0.964  -1.564  -0.071  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.331  -1.574   0.743  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.476  -1.030  -0.114  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.772  -1.040   0.700  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.917  -0.496  -0.156  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.212  -0.506   0.658  1.00  0.00           C  
HETATM   24  C   UNL     1      -6.357   0.038  -0.199  1.00  0.00           C  
HETATM   25  C   UNL     1      -7.652   0.029   0.615  1.00  0.00           C  
HETATM   26  C   UNL     1      -8.797   0.573  -0.242  1.00  0.00           C  
HETATM   27  C   UNL     1     -10.093   0.563   0.572  1.00  0.00           C  
HETATM   28  C   UNL     1     -11.220   1.099  -0.272  1.00  0.00           C  
HETATM   29  O   UNL     1     -11.010   1.452  -1.408  1.00  0.00           O  
HETATM   30  O   UNL     1     -12.459   1.183   0.239  1.00  0.00           O  
HETATM   31  H   UNL     1       5.779   1.969  -2.389  1.00  0.00           H  
HETATM   32  H   UNL     1       4.025  -1.898  -2.671  1.00  0.00           H  
HETATM   33  H   UNL     1       5.028   0.079  -3.731  1.00  0.00           H  
HETATM   34  H   UNL     1       5.792   2.896   2.281  1.00  0.00           H  
HETATM   35  H   UNL     1       4.783   0.913   3.323  1.00  0.00           H  
HETATM   36  H   UNL     1       4.037  -0.967   1.972  1.00  0.00           H  
HETATM   37  H   UNL     1       5.375   4.627   1.096  1.00  0.00           H  
HETATM   38  H   UNL     1       5.885   5.349  -0.449  1.00  0.00           H  
HETATM   39  H   UNL     1       4.403   4.365  -0.372  1.00  0.00           H  
HETATM   40  H   UNL     1       8.169   2.560  -0.161  1.00  0.00           H  
HETATM   41  H   UNL     1       8.019   4.326  -0.329  1.00  0.00           H  
HETATM   42  H   UNL     1       7.635   3.543   1.223  1.00  0.00           H  
HETATM   43  H   UNL     1       1.958  -2.148   1.712  1.00  0.00           H  
HETATM   44  H   UNL     1       1.193  -0.543  -0.377  1.00  0.00           H  
HETATM   45  H   UNL     1       0.842  -2.190  -0.955  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.560  -2.595   1.049  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.210  -0.948   1.627  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.247  -0.009  -0.420  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.598  -1.656  -0.998  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.000  -2.061   1.007  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.650  -0.414   1.584  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.688   0.525  -0.463  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.038  -1.122  -1.041  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.441  -1.526   0.964  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.090   0.120   1.542  1.00  0.00           H  
HETATM   56  H   UNL     1      -6.128   1.059  -0.506  1.00  0.00           H  
HETATM   57  H   UNL     1      -6.478  -0.587  -1.083  1.00  0.00           H  
HETATM   58  H   UNL     1      -7.881  -0.992   0.921  1.00  0.00           H  
HETATM   59  H   UNL     1      -7.531   0.655   1.499  1.00  0.00           H  
HETATM   60  H   UNL     1      -8.568   1.594  -0.548  1.00  0.00           H  
HETATM   61  H   UNL     1      -8.919  -0.053  -1.126  1.00  0.00           H  
HETATM   62  H   UNL     1     -10.321  -0.458   0.878  1.00  0.00           H  
HETATM   63  H   UNL     1      -9.971   1.189   1.456  1.00  0.00           H  
HETATM   64  H   UNL     1     -13.149   1.533  -0.341  1.00  0.00           H  
CONECT    1    2    2    6   31                                       
CONECT    2    1    1    7    3                                       
CONECT    3    2   10    4    4                                       
CONECT    4    3    3   14    5                                       
CONECT    5    4    6    6   32                                       
CONECT    6    1    5    5   33                                       
CONECT    7    2    8    8   11                                       
CONECT    8    7    7    9   34                                       
CONECT    9    8   10   10   35                                       
CONECT   10    3    9    9   36                                       
CONECT   11    7   13   12                                            
CONECT   12   11   37   38   39                                       
CONECT   13   11   40   41   42                                       
CONECT   14    4   17   16   16                                       
CONECT   14   15   15                                                 
CONECT   15   14   14                                                 
CONECT   16   14   14                                                 
CONECT   17   14   18   43                                            
CONECT   18   17   19   44   45                                       
CONECT   19   18   20   46   47                                       
CONECT   20   19   21   48   49                                       
CONECT   21   20   22   50   51                                       
CONECT   22   21   23   52   53                                       
CONECT   23   22   24   54   55                                       
CONECT   24   23   25   56   57                                       
CONECT   25   24   26   58   59                                       
CONECT   26   25   27   60   61                                       
CONECT   27   26   28   62   63                                       
CONECT   28   27   29   29   30                                       
CONECT   29   28   28                                                 
CONECT   30   28   64                                                 
CONECT   31    1                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    8                                                      
CONECT   35    9                                                      
CONECT   36   10                                                      
CONECT   37   12                                                      
CONECT   38   12                                                      
CONECT   39   12                                                      
CONECT   40   13                                                      
CONECT   41   13                                                      
CONECT   42   13                                                      
CONECT   43   17                                                      
CONECT   44   18                                                      
CONECT   45   18                                                      
CONECT   46   19                                                      
CONECT   47   19                                                      
CONECT   48   20                                                      
CONECT   49   20                                                      
CONECT   50   21                                                      
CONECT   51   21                                                      
CONECT   52   22                                                      
CONECT   53   22                                                      
CONECT   54   23                                                      
CONECT   55   23                                                      
CONECT   56   24                                                      
CONECT   57   24                                                      
CONECT   58   25                                                      
CONECT   59   25                                                      
CONECT   60   26                                                      
CONECT   61   26                                                      
CONECT   62   27                                                      
CONECT   63   27                                                      
CONECT   64   30                                                      
MASTER        0    0    0    0    0    0    0    0   64    0   64    0
END
