COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.806   2.542   1.712  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.678   1.767   0.399  1.00  0.00           C  
HETATM    3  C   UNL     1       3.038  -0.041  -0.132  1.00  0.00           C  
HETATM    4  C   UNL     1       3.849  -0.533  -1.095  1.00  0.00           C  
HETATM    5  C   UNL     1       3.571  -0.361  -2.566  1.00  0.00           C  
HETATM    6  C   UNL     1       1.788   0.712  -0.348  1.00  0.00           C  
HETATM    7  C   UNL     1       0.651   0.651   0.428  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.678   0.670   0.138  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.689   0.023  -1.084  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.605  -0.982  -1.327  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.514  -1.342  -0.343  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.501  -0.692   0.882  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.579   0.309   1.122  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.322  -2.649   0.480  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.191   3.209   0.390  1.00  0.00           C  
HETATM   16  S   UNL     1       3.736  -0.466   1.429  1.00  0.00           S  
HETATM   17  N   UNL     1       4.902  -1.172  -0.638  1.00  0.00           N  
HETATM   18  C   UNL     1       5.039  -1.247   0.644  1.00  0.00           C  
HETATM   19  C   UNL     1       6.178  -1.937   1.349  1.00  0.00           C  
HETATM   20  N   UNL     1       1.543   1.603  -1.352  1.00  0.00           N  
HETATM   21  N   UNL     1       0.238   2.085  -1.185  1.00  0.00           N  
HETATM   22  C   UNL     1      -0.288   1.519  -0.129  1.00  0.00           C  
HETATM   23  O   UNL     1      -5.416  -2.331  -0.579  1.00  0.00           O  
HETATM   24  H   UNL     1      -2.614   2.258   2.387  1.00  0.00           H  
HETATM   25  H   UNL     1      -0.886   2.872   2.194  1.00  0.00           H  
HETATM   26  H   UNL     1       4.037   0.558  -2.920  1.00  0.00           H  
HETATM   27  H   UNL     1       3.979  -1.210  -3.115  1.00  0.00           H  
HETATM   28  H   UNL     1       2.494  -0.308  -2.729  1.00  0.00           H  
HETATM   29  H   UNL     1       0.512   0.043   1.309  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.981   0.305  -1.850  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.613  -1.487  -2.282  1.00  0.00           H  
HETATM   32  H   UNL     1      -5.207  -0.970   1.650  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.565   0.813   2.077  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.986  -3.452   0.161  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.758  -2.970   1.356  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.912  -1.768   0.730  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.252   3.364   0.195  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.523   3.978   0.002  1.00  0.00           H  
HETATM   39  H   UNL     1       6.988  -1.226   1.513  1.00  0.00           H  
HETATM   40  H   UNL     1       5.833  -2.322   2.309  1.00  0.00           H  
HETATM   41  H   UNL     1       6.538  -2.763   0.735  1.00  0.00           H  
HETATM   42  H   UNL     1       2.161   1.857  -2.055  1.00  0.00           H  
CONECT    1   15    2   24   25                                       
CONECT    2   22   15    8    1                                       
CONECT    3    4    4   16    6                                       
CONECT    4   17    5    3    3                                       
CONECT    5    4   26   27   28                                       
CONECT    6    3   20    7    7                                       
CONECT    7    6    6   22   29                                       
CONECT    8    2   13   13    9                                       
CONECT    9    8   10   10   30                                       
CONECT   10    9    9   11   31                                       
CONECT   11   12   12   10   23                                       
CONECT   12   13   11   11   32                                       
CONECT   13    8    8   12   33                                       
CONECT   14   23   34   35   36                                       
CONECT   15    2    1   37   38                                       
CONECT   16   18    3                                                 
CONECT   17   18   18    4                                            
CONECT   18   19   17   17   16                                       
CONECT   19   18   39   40   41                                       
CONECT   20    6   21   42                                            
CONECT   21   20   22   22                                            
CONECT   22   21   21    7    2                                       
CONECT   23   11   14                                                 
CONECT   24    1                                                      
CONECT   25    1                                                      
CONECT   26    5                                                      
CONECT   27    5                                                      
CONECT   28    5                                                      
CONECT   29    7                                                      
CONECT   30    9                                                      
CONECT   31   10                                                      
CONECT   32   12                                                      
CONECT   33   13                                                      
CONECT   34   14                                                      
CONECT   35   14                                                      
CONECT   36   14                                                      
CONECT   37   15                                                      
CONECT   38   15                                                      
CONECT   39   19                                                      
CONECT   40   19                                                      
CONECT   41   19                                                      
CONECT   42   20                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
