COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.237  -0.565  -0.659  1.00  0.00           C  
HETATM    2  C   UNL     1       1.874  -0.483  -1.193  1.00  0.00           C  
HETATM    3  C   UNL     1       2.981   1.673   0.141  1.00  0.00           C  
HETATM    4  O   UNL     1       1.373  -1.425  -1.782  1.00  0.00           O  
HETATM    5  O   UNL     1      -0.753  -0.048   0.599  1.00  0.00           O  
HETATM    6  C   UNL     1       3.551   2.867   0.862  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.856   0.068  -0.247  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.431  -0.066   0.292  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.851  -0.392   0.821  1.00  0.00           C  
HETATM   10  C   UNL     1      -8.169  -1.022   1.121  1.00  0.00           C  
HETATM   11  C   UNL     1      -7.613   1.163   0.238  1.00  0.00           C  
HETATM   12  C   UNL     1      -8.039  -2.509   0.785  1.00  0.00           C  
HETATM   13  C   UNL     1      -8.933   1.289  -0.525  1.00  0.00           C  
HETATM   14  N   UNL     1       3.753   0.538   0.002  1.00  0.00           N  
HETATM   15  C   UNL     1       4.190  -1.551  -0.668  1.00  0.00           C  
HETATM   16  N   UNL     1       1.190   0.669  -1.011  1.00  0.00           N  
HETATM   17  C   UNL     1       5.042   0.238   0.417  1.00  0.00           C  
HETATM   18  N   UNL     1       1.783   1.737  -0.332  1.00  0.00           N  
HETATM   19  C   UNL     1       5.320  -1.053   0.008  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.175   0.798  -1.527  1.00  0.00           C  
HETATM   21  C   UNL     1       6.109   0.834   1.102  1.00  0.00           C  
HETATM   22  S   UNL     1       6.950  -1.492   0.507  1.00  0.00           S  
HETATM   23  C   UNL     1      -1.155   0.344  -0.476  1.00  0.00           C  
HETATM   24  C   UNL     1       7.191   0.081   1.248  1.00  0.00           C  
HETATM   25  N   UNL     1      -2.478   0.374  -0.730  1.00  0.00           N  
HETATM   26  N   UNL     1      -7.220  -0.251   0.308  1.00  0.00           N  
HETATM   27  H   UNL     1       2.813   3.669   0.879  1.00  0.00           H  
HETATM   28  H   UNL     1       3.807   2.587   1.884  1.00  0.00           H  
HETATM   29  H   UNL     1       4.447   3.210   0.344  1.00  0.00           H  
HETATM   30  H   UNL     1      -5.052   1.110  -0.501  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.967  -0.550  -1.138  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.319   0.552   1.183  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.235  -1.108   0.546  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.661  -1.437   1.067  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.733   0.220   1.715  1.00  0.00           H  
HETATM   36  H   UNL     1      -9.185  -0.688   0.908  1.00  0.00           H  
HETATM   37  H   UNL     1      -7.951  -0.867   2.178  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.839   1.730  -0.278  1.00  0.00           H  
HETATM   39  H   UNL     1      -7.738   1.555   1.248  1.00  0.00           H  
HETATM   40  H   UNL     1      -8.809  -3.070   1.316  1.00  0.00           H  
HETATM   41  H   UNL     1      -8.161  -2.650  -0.289  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.055  -2.865   1.089  1.00  0.00           H  
HETATM   43  H   UNL     1      -8.807   0.897  -1.534  1.00  0.00           H  
HETATM   44  H   UNL     1      -9.707   0.722  -0.008  1.00  0.00           H  
HETATM   45  H   UNL     1      -9.224   2.338  -0.576  1.00  0.00           H  
HETATM   46  H   UNL     1       4.091  -2.531  -1.111  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.371   1.839  -1.781  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.287   0.180  -2.418  1.00  0.00           H  
HETATM   49  H   UNL     1       6.054   1.842   1.487  1.00  0.00           H  
HETATM   50  H   UNL     1       8.095   0.393   1.751  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.800   0.688  -1.589  1.00  0.00           H  
CONECT    1   15   15   14    2                                       
CONECT    2    1    4    4   16                                       
CONECT    3   14    6   18   18                                       
CONECT    4    2    2                                                 
CONECT    5   23   23                                                 
CONECT    6    3   27   28   29                                       
CONECT    7    8    9   30   31                                       
CONECT    8   25    7   32   33                                       
CONECT    9    7   26   34   35                                       
CONECT   10   26   12   36   37                                       
CONECT   11   26   13   38   39                                       
CONECT   12   10   40   41   42                                       
CONECT   13   11   43   44   45                                       
CONECT   14   17    1    3                                            
CONECT   15   19    1    1   46                                       
CONECT   16    2   18   20                                            
CONECT   17   21   19   19   14                                       
CONECT   18    3    3   16                                            
CONECT   19   22   17   17   15                                       
CONECT   20   16   23   47   48                                       
CONECT   21   24   24   17   49                                       
CONECT   22   24   19                                                 
CONECT   23   20    5    5   25                                       
CONECT   24   22   21   21   50                                       
CONECT   25   23    8   51                                            
CONECT   26    9   10   11                                            
CONECT   27    6                                                      
CONECT   28    6                                                      
CONECT   29    6                                                      
CONECT   30    7                                                      
CONECT   31    7                                                      
CONECT   32    8                                                      
CONECT   33    8                                                      
CONECT   34    9                                                      
CONECT   35    9                                                      
CONECT   36   10                                                      
CONECT   37   10                                                      
CONECT   38   11                                                      
CONECT   39   11                                                      
CONECT   40   12                                                      
CONECT   41   12                                                      
CONECT   42   12                                                      
CONECT   43   13                                                      
CONECT   44   13                                                      
CONECT   45   13                                                      
CONECT   46   15                                                      
CONECT   47   20                                                      
CONECT   48   20                                                      
CONECT   49   21                                                      
CONECT   50   24                                                      
CONECT   51   25                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
