COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -0.732   3.924  -0.261  1.00  0.00           O  
HETATM    2  C   UNL     1      -1.053   2.557  -0.530  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.388   2.205   0.134  1.00  0.00           C  
HETATM    4  O   UNL     1      -3.431   2.993  -0.442  1.00  0.00           O  
HETATM    5  C   UNL     1      -2.682   0.719  -0.095  1.00  0.00           C  
HETATM    6  O   UNL     1      -3.889   0.362   0.582  1.00  0.00           O  
HETATM    7  C   UNL     1      -5.076   0.619  -0.172  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.298   0.498   0.743  1.00  0.00           C  
HETATM    9  O   UNL     1      -6.167   1.407   1.838  1.00  0.00           O  
HETATM   10  C   UNL     1      -6.387  -0.936   1.275  1.00  0.00           C  
HETATM   11  O   UNL     1      -7.565  -1.078   2.071  1.00  0.00           O  
HETATM   12  C   UNL     1      -6.448  -1.905   0.091  1.00  0.00           C  
HETATM   13  O   UNL     1      -6.458  -3.250   0.575  1.00  0.00           O  
HETATM   14  C   UNL     1      -5.220  -1.691  -0.799  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.305  -2.614  -2.016  1.00  0.00           C  
HETATM   16  O   UNL     1      -4.106  -2.499  -2.784  1.00  0.00           O  
HETATM   17  O   UNL     1      -5.181  -0.330  -1.234  1.00  0.00           O  
HETATM   18  C   UNL     1      -1.522  -0.114   0.455  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.781  -1.596   0.177  1.00  0.00           C  
HETATM   20  O   UNL     1      -0.746  -2.381   0.774  1.00  0.00           O  
HETATM   21  O   UNL     1      -0.306   0.285  -0.182  1.00  0.00           O  
HETATM   22  C   UNL     1       0.045   1.653   0.037  1.00  0.00           C  
HETATM   23  S   UNL     1       1.616   2.015  -0.794  1.00  0.00           S  
HETATM   24  C   UNL     1       2.801   0.975   0.102  1.00  0.00           C  
HETATM   25  C   UNL     1       4.199   1.169  -0.489  1.00  0.00           C  
HETATM   26  C   UNL     1       5.199   0.292   0.268  1.00  0.00           C  
HETATM   27  C   UNL     1       6.596   0.485  -0.323  1.00  0.00           C  
HETATM   28  C   UNL     1       7.596  -0.392   0.433  1.00  0.00           C  
HETATM   29  C   UNL     1       8.994  -0.198  -0.158  1.00  0.00           C  
HETATM   30  C   UNL     1       9.994  -1.075   0.599  1.00  0.00           C  
HETATM   31  C   UNL     1      11.391  -0.882   0.008  1.00  0.00           C  
HETATM   32  C   UNL     1      12.391  -1.759   0.764  1.00  0.00           C  
HETATM   33  C   UNL     1      13.789  -1.565   0.173  1.00  0.00           C  
HETATM   34  H   UNL     1       0.103   4.216  -0.652  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.130   2.406  -1.607  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.327   2.405   1.204  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.305   3.947  -0.340  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.794   0.530  -1.162  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.031   1.626  -0.587  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.200   0.735   0.179  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.100   2.334   1.573  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.508  -1.155   1.882  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.596  -0.488   2.836  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.354  -1.719  -0.486  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.208  -3.455   1.150  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.317  -1.918  -0.232  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.425  -3.645  -1.682  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.159  -2.329  -2.630  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.089  -3.058  -3.573  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.438   0.045   1.531  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.744  -1.882   0.600  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.791  -1.767  -0.900  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.846  -3.333   0.637  1.00  0.00           H  
HETATM   54  H   UNL     1       0.149   1.835   1.107  1.00  0.00           H  
HETATM   55  H   UNL     1       2.809   1.258   1.155  1.00  0.00           H  
HETATM   56  H   UNL     1       2.509  -0.071   0.010  1.00  0.00           H  
HETATM   57  H   UNL     1       4.191   0.885  -1.541  1.00  0.00           H  
HETATM   58  H   UNL     1       4.491   2.215  -0.396  1.00  0.00           H  
HETATM   59  H   UNL     1       5.207   0.575   1.321  1.00  0.00           H  
HETATM   60  H   UNL     1       4.907  -0.754   0.176  1.00  0.00           H  
HETATM   61  H   UNL     1       6.588   0.202  -1.376  1.00  0.00           H  
HETATM   62  H   UNL     1       6.888   1.531  -0.231  1.00  0.00           H  
HETATM   63  H   UNL     1       7.604  -0.108   1.486  1.00  0.00           H  
HETATM   64  H   UNL     1       7.304  -1.438   0.341  1.00  0.00           H  
HETATM   65  H   UNL     1       8.986  -0.482  -1.210  1.00  0.00           H  
HETATM   66  H   UNL     1       9.286   0.848  -0.065  1.00  0.00           H  
HETATM   67  H   UNL     1      10.002  -0.792   1.651  1.00  0.00           H  
HETATM   68  H   UNL     1       9.702  -2.121   0.507  1.00  0.00           H  
HETATM   69  H   UNL     1      11.383  -1.165  -1.045  1.00  0.00           H  
HETATM   70  H   UNL     1      11.683   0.165   0.100  1.00  0.00           H  
HETATM   71  H   UNL     1      12.399  -1.475   1.817  1.00  0.00           H  
HETATM   72  H   UNL     1      12.099  -2.805   0.672  1.00  0.00           H  
HETATM   73  H   UNL     1      13.781  -1.848  -0.879  1.00  0.00           H  
HETATM   74  H   UNL     1      14.081  -0.519   0.265  1.00  0.00           H  
HETATM   75  H   UNL     1      14.501  -2.190   0.712  1.00  0.00           H  
CONECT    1    2   34                                                 
CONECT    2    1    3   22   35                                       
CONECT    3    2    4    5   36                                       
CONECT    4    3   37                                                 
CONECT    5    3    6   18   38                                       
CONECT    6    5    7                                                 
CONECT    7    6    8   17   39                                       
CONECT    8    7    9   10   40                                       
CONECT    9    8   41                                                 
CONECT   10    8   11   12   42                                       
CONECT   11   10   43                                                 
CONECT   12   10   13   14   44                                       
CONECT   13   12   45                                                 
CONECT   14   12   15   17   46                                       
CONECT   15   14   16   47   48                                       
CONECT   16   15   49                                                 
CONECT   17    7   14                                                 
CONECT   18    5   19   21   50                                       
CONECT   19   18   20   51   52                                       
CONECT   20   19   53                                                 
CONECT   21   18   22                                                 
CONECT   22    2   21   23   54                                       
CONECT   23   22   24                                                 
CONECT   24   23   25   55   56                                       
CONECT   25   24   26   57   58                                       
CONECT   26   25   27   59   60                                       
CONECT   27   26   28   61   62                                       
CONECT   28   27   29   63   64                                       
CONECT   29   28   30   65   66                                       
CONECT   30   29   31   67   68                                       
CONECT   31   30   32   69   70                                       
CONECT   32   31   33   71   72                                       
CONECT   33   32   73   74   75                                       
CONECT   34    1                                                      
CONECT   35    2                                                      
CONECT   36    3                                                      
CONECT   37    4                                                      
CONECT   38    5                                                      
CONECT   39    7                                                      
CONECT   40    8                                                      
CONECT   41    9                                                      
CONECT   42   10                                                      
CONECT   43   11                                                      
CONECT   44   12                                                      
CONECT   45   13                                                      
CONECT   46   14                                                      
CONECT   47   15                                                      
CONECT   48   15                                                      
CONECT   49   16                                                      
CONECT   50   18                                                      
CONECT   51   19                                                      
CONECT   52   19                                                      
CONECT   53   20                                                      
CONECT   54   22                                                      
CONECT   55   24                                                      
CONECT   56   24                                                      
CONECT   57   25                                                      
CONECT   58   25                                                      
CONECT   59   26                                                      
CONECT   60   26                                                      
CONECT   61   27                                                      
CONECT   62   27                                                      
CONECT   63   28                                                      
CONECT   64   28                                                      
CONECT   65   29                                                      
CONECT   66   29                                                      
CONECT   67   30                                                      
CONECT   68   30                                                      
CONECT   69   31                                                      
CONECT   70   31                                                      
CONECT   71   32                                                      
CONECT   72   32                                                      
CONECT   73   33                                                      
CONECT   74   33                                                      
CONECT   75   33                                                      
MASTER        0    0    0    0    0    0    0    0   75    0   75    0
END
