COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -5.391   2.096   1.136  1.00  0.00           O  
HETATM    2  C   UNL     1      -6.487   2.534   0.841  1.00  0.00           C  
HETATM    3  N   UNL     1      -7.042   3.516   1.579  1.00  0.00           N  
HETATM    4  C   UNL     1      -7.178   2.016  -0.284  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.583   1.111  -1.080  1.00  0.00           C  
HETATM    6  O   UNL     1      -7.304   0.456  -2.012  1.00  0.00           O  
HETATM    7  C   UNL     1      -8.717   0.778  -2.099  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.110   0.829  -0.931  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.489   0.620  -2.313  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.916  -0.432  -0.087  1.00  0.00           C  
HETATM   11  O   UNL     1      -5.428  -1.563  -0.796  1.00  0.00           O  
HETATM   12  C   UNL     1      -5.930  -2.600   0.049  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.447  -0.633   0.185  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.001  -0.654   1.433  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.561  -0.851   1.700  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.056  -0.880   2.951  1.00  0.00           C  
HETATM   17  N   UNL     1      -0.677  -1.016   0.729  1.00  0.00           N  
HETATM   18  C   UNL     1       0.563  -1.181   1.081  1.00  0.00           C  
HETATM   19  C   UNL     1       1.696  -1.379   0.153  1.00  0.00           C  
HETATM   20  C   UNL     1       1.550  -1.409  -1.190  1.00  0.00           C  
HETATM   21  N   UNL     1       2.947  -1.538   0.562  1.00  0.00           N  
HETATM   22  C   UNL     1       3.846  -1.702  -0.345  1.00  0.00           C  
HETATM   23  C   UNL     1       5.315  -1.896  -0.072  1.00  0.00           C  
HETATM   24  C   UNL     1       5.764  -3.246  -0.637  1.00  0.00           C  
HETATM   25  C   UNL     1       6.099  -0.790  -0.730  1.00  0.00           C  
HETATM   26  C   UNL     1       6.853   0.018   0.006  1.00  0.00           C  
HETATM   27  C   UNL     1       7.619   1.098  -0.636  1.00  0.00           C  
HETATM   28  C   UNL     1       8.373   1.907   0.101  1.00  0.00           C  
HETATM   29  C   UNL     1       9.157   3.013  -0.557  1.00  0.00           C  
HETATM   30  C   UNL     1       8.708   4.362   0.007  1.00  0.00           C  
HETATM   31  C   UNL     1      10.649   2.815  -0.281  1.00  0.00           C  
HETATM   32  S   UNL     1       0.684  -1.133   2.837  1.00  0.00           S  
HETATM   33  S   UNL     1       3.141  -1.665  -1.901  1.00  0.00           S  
HETATM   34  H   UNL     1      -6.568   3.873   2.346  1.00  0.00           H  
HETATM   35  H   UNL     1      -7.916   3.865   1.344  1.00  0.00           H  
HETATM   36  H   UNL     1      -8.183   2.349  -0.501  1.00  0.00           H  
HETATM   37  H   UNL     1      -9.200   0.557  -1.146  1.00  0.00           H  
HETATM   38  H   UNL     1      -8.835   1.837  -2.329  1.00  0.00           H  
HETATM   39  H   UNL     1      -9.178   0.182  -2.886  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.627   1.673  -0.439  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.628   1.518  -2.914  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.424   0.416  -2.205  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.973  -0.225  -2.805  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.449  -0.324   0.857  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.133  -2.955   0.702  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.749  -2.210   0.654  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.292  -3.425  -0.564  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.758  -0.760  -0.637  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.690  -0.527   2.255  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.621  -0.768   3.865  1.00  0.00           H  
HETATM   51  H   UNL     1       0.622  -1.297  -1.732  1.00  0.00           H  
HETATM   52  H   UNL     1       5.491  -1.876   1.003  1.00  0.00           H  
HETATM   53  H   UNL     1       5.588  -3.266  -1.712  1.00  0.00           H  
HETATM   54  H   UNL     1       6.827  -3.387  -0.440  1.00  0.00           H  
HETATM   55  H   UNL     1       5.197  -4.046  -0.161  1.00  0.00           H  
HETATM   56  H   UNL     1       6.048  -0.655  -1.800  1.00  0.00           H  
HETATM   57  H   UNL     1       6.904  -0.117   1.077  1.00  0.00           H  
HETATM   58  H   UNL     1       7.568   1.233  -1.706  1.00  0.00           H  
HETATM   59  H   UNL     1       8.424   1.772   1.171  1.00  0.00           H  
HETATM   60  H   UNL     1       8.981   2.993  -1.633  1.00  0.00           H  
HETATM   61  H   UNL     1       8.884   4.382   1.083  1.00  0.00           H  
HETATM   62  H   UNL     1       9.275   5.162  -0.468  1.00  0.00           H  
HETATM   63  H   UNL     1       7.645   4.503  -0.190  1.00  0.00           H  
HETATM   64  H   UNL     1      10.968   1.854  -0.683  1.00  0.00           H  
HETATM   65  H   UNL     1      11.216   3.615  -0.757  1.00  0.00           H  
HETATM   66  H   UNL     1      10.824   2.835   0.795  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    4                                       
CONECT    3    2   34   35                                            
CONECT    4    2    5    5   36                                       
CONECT    5    4    4    6    8                                       
CONECT    6    5    7                                                 
CONECT    7    6   37   38   39                                       
CONECT    8    5    9   10   40                                       
CONECT    9    8   41   42   43                                       
CONECT   10    8   11   13   44                                       
CONECT   11   10   12                                                 
CONECT   12   11   45   46   47                                       
CONECT   13   10   14   14   48                                       
CONECT   14   13   13   15   49                                       
CONECT   15   14   16   16   17                                       
CONECT   16   15   15   32   50                                       
CONECT   17   15   18   18                                            
CONECT   18   17   17   19   32                                       
CONECT   19   18   20   20   21                                       
CONECT   20   19   19   33   51                                       
CONECT   21   19   22   22                                            
CONECT   22   21   21   23   33                                       
CONECT   23   22   24   25   52                                       
CONECT   24   23   53   54   55                                       
CONECT   25   23   26   26   56                                       
CONECT   26   25   25   27   57                                       
CONECT   27   26   28   28   58                                       
CONECT   28   27   27   29   59                                       
CONECT   29   28   30   31   60                                       
CONECT   30   29   61   62   63                                       
CONECT   31   29   64   65   66                                       
CONECT   32   16   18                                                 
CONECT   33   20   22                                                 
CONECT   34    3                                                      
CONECT   35    3                                                      
CONECT   36    4                                                      
CONECT   37    7                                                      
CONECT   38    7                                                      
CONECT   39    7                                                      
CONECT   40    8                                                      
CONECT   41    9                                                      
CONECT   42    9                                                      
CONECT   43    9                                                      
CONECT   44   10                                                      
CONECT   45   12                                                      
CONECT   46   12                                                      
CONECT   47   12                                                      
CONECT   48   13                                                      
CONECT   49   14                                                      
CONECT   50   16                                                      
CONECT   51   20                                                      
CONECT   52   23                                                      
CONECT   53   24                                                      
CONECT   54   24                                                      
CONECT   55   24                                                      
CONECT   56   25                                                      
CONECT   57   26                                                      
CONECT   58   27                                                      
CONECT   59   28                                                      
CONECT   60   29                                                      
CONECT   61   30                                                      
CONECT   62   30                                                      
CONECT   63   30                                                      
CONECT   64   31                                                      
CONECT   65   31                                                      
CONECT   66   31                                                      
MASTER        0    0    0    0    0    0    0    0   66    0   66    0
END
