COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.995  -5.472   0.610  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.421  -5.121  -0.817  1.00  0.00           C  
HETATM    3  C   UNL     1      -6.508  -4.067   0.288  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.500  -2.947   0.262  1.00  0.00           C  
HETATM    5  O   UNL     1      -4.332  -3.177   0.491  1.00  0.00           O  
HETATM    6  N   UNL     1      -5.897  -1.689  -0.015  1.00  0.00           N  
HETATM    7  C   UNL     1      -4.971  -0.660  -0.040  1.00  0.00           C  
HETATM    8  N   UNL     1      -5.248   0.572  -0.294  1.00  0.00           N  
HETATM    9  S   UNL     1      -3.253  -0.850   0.280  1.00  0.00           S  
HETATM   10  C   UNL     1      -3.000   0.876   0.023  1.00  0.00           C  
HETATM   11  N   UNL     1      -1.896   1.612   0.080  1.00  0.00           N  
HETATM   12  C   UNL     1      -4.237   1.460  -0.279  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.273   2.852  -0.521  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.112   3.567  -0.453  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.915   2.915  -0.149  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.655   3.693  -0.074  1.00  0.00           C  
HETATM   17  C   UNL     1       0.543   3.053   0.236  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.664   5.065  -0.319  1.00  0.00           C  
HETATM   19  C   UNL     1       0.510   5.787  -0.249  1.00  0.00           C  
HETATM   20  C   UNL     1       1.698   5.154   0.063  1.00  0.00           C  
HETATM   21  C   UNL     1       1.718   3.786   0.305  1.00  0.00           C  
HETATM   22  N   UNL     1       2.924   3.147   0.617  1.00  0.00           N  
HETATM   23  C   UNL     1       3.139   1.879   0.213  1.00  0.00           C  
HETATM   24  O   UNL     1       2.329   1.323  -0.503  1.00  0.00           O  
HETATM   25  N   UNL     1       4.252   1.228   0.604  1.00  0.00           N  
HETATM   26  C   UNL     1       4.486  -0.150   0.165  1.00  0.00           C  
HETATM   27  C   UNL     1       5.811  -0.652   0.744  1.00  0.00           C  
HETATM   28  N   UNL     1       6.045  -2.034   0.305  1.00  0.00           N  
HETATM   29  C   UNL     1       7.179  -2.630   1.025  1.00  0.00           C  
HETATM   30  C   UNL     1       7.351  -4.085   0.581  1.00  0.00           C  
HETATM   31  O   UNL     1       7.528  -4.128  -0.837  1.00  0.00           O  
HETATM   32  C   UNL     1       6.441  -3.556  -1.571  1.00  0.00           C  
HETATM   33  C   UNL     1       6.261  -2.095  -1.148  1.00  0.00           C  
HETATM   34  H   UNL     1      -6.649  -6.128   1.184  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.928  -5.586   0.803  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.635  -5.005  -1.563  1.00  0.00           H  
HETATM   37  H   UNL     1      -7.356  -5.547  -1.181  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.500  -3.798   0.651  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.206   3.343  -0.757  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.119   4.631  -0.635  1.00  0.00           H  
HETATM   41  H   UNL     1       0.556   1.989   0.424  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.590   5.564  -0.564  1.00  0.00           H  
HETATM   43  H   UNL     1       0.501   6.851  -0.440  1.00  0.00           H  
HETATM   44  H   UNL     1       2.614   5.723   0.116  1.00  0.00           H  
HETATM   45  H   UNL     1       3.605   3.617   1.123  1.00  0.00           H  
HETATM   46  H   UNL     1       4.899   1.672   1.175  1.00  0.00           H  
HETATM   47  H   UNL     1       3.673  -0.786   0.515  1.00  0.00           H  
HETATM   48  H   UNL     1       4.530  -0.183  -0.923  1.00  0.00           H  
HETATM   49  H   UNL     1       6.624  -0.016   0.394  1.00  0.00           H  
HETATM   50  H   UNL     1       5.767  -0.619   1.833  1.00  0.00           H  
HETATM   51  H   UNL     1       8.088  -2.072   0.800  1.00  0.00           H  
HETATM   52  H   UNL     1       6.987  -2.598   2.098  1.00  0.00           H  
HETATM   53  H   UNL     1       8.225  -4.515   1.070  1.00  0.00           H  
HETATM   54  H   UNL     1       6.463  -4.656   0.854  1.00  0.00           H  
HETATM   55  H   UNL     1       6.658  -3.602  -2.638  1.00  0.00           H  
HETATM   56  H   UNL     1       5.527  -4.111  -1.360  1.00  0.00           H  
HETATM   57  H   UNL     1       5.398  -1.671  -1.662  1.00  0.00           H  
HETATM   58  H   UNL     1       7.155  -1.528  -1.408  1.00  0.00           H  
HETATM   59  H   UNL     1      -6.832  -1.505  -0.199  1.00  0.00           H  
CONECT    1    2    3   34   35                                       
CONECT    2    1    3   36   37                                       
CONECT    3    1    2    4   38                                       
CONECT    4    3    5    5    6                                       
CONECT    5    4    4                                                 
CONECT    6    4    7   59                                            
CONECT    7    6    8    8    9                                       
CONECT    8    7    7   12                                            
CONECT    9    7   10                                                 
CONECT   10    9   11   11   12                                       
CONECT   11   10   10   15                                            
CONECT   12    8   10   13   13                                       
CONECT   13   12   12   14   39                                       
CONECT   14   13   15   15   40                                       
CONECT   15   11   14   14   16                                       
CONECT   16   15   17   17   18                                       
CONECT   17   16   16   21   41                                       
CONECT   18   16   19   19   42                                       
CONECT   19   18   18   20   43                                       
CONECT   20   19   21   21   44                                       
CONECT   21   17   20   20   22                                       
CONECT   22   21   23   45                                            
CONECT   23   22   24   24   25                                       
CONECT   24   23   23                                                 
CONECT   25   23   26   46                                            
CONECT   26   25   27   47   48                                       
CONECT   27   26   28   49   50                                       
CONECT   28   27   29   33                                            
CONECT   29   28   30   51   52                                       
CONECT   30   29   31   53   54                                       
CONECT   31   30   32                                                 
CONECT   32   31   33   55   56                                       
CONECT   33   28   32   57   58                                       
CONECT   34    1                                                      
CONECT   35    1                                                      
CONECT   36    2                                                      
CONECT   37    2                                                      
CONECT   38    3                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   17                                                      
CONECT   42   18                                                      
CONECT   43   19                                                      
CONECT   44   20                                                      
CONECT   45   22                                                      
CONECT   46   25                                                      
CONECT   47   26                                                      
CONECT   48   26                                                      
CONECT   49   27                                                      
CONECT   50   27                                                      
CONECT   51   29                                                      
CONECT   52   29                                                      
CONECT   53   30                                                      
CONECT   54   30                                                      
CONECT   55   32                                                      
CONECT   56   32                                                      
CONECT   57   33                                                      
CONECT   58   33                                                      
CONECT   59    6                                                      
MASTER        0    0    0    0    0    0    0    0   59    0   59    0
END
