COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.362   1.502  -0.056  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.756   1.944  -0.497  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.818   1.085   0.138  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.110   1.593   0.194  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.131   0.854   0.754  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.869  -0.404   1.263  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.587  -0.910   1.212  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.557  -0.165   0.653  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.174  -0.765   0.653  1.00  0.00           C  
HETATM   10  N   UNL     1      -1.286   0.038  -0.194  1.00  0.00           N  
HETATM   11  S   UNL     1      -0.242  -0.672  -1.264  1.00  0.00           S  
HETATM   12  O   UNL     1      -0.777  -1.956  -1.556  1.00  0.00           O  
HETATM   13  O   UNL     1       0.033   0.300  -2.263  1.00  0.00           O  
HETATM   14  C   UNL     1       1.274  -0.948  -0.409  1.00  0.00           C  
HETATM   15  C   UNL     1       2.251   0.026  -0.408  1.00  0.00           C  
HETATM   16  C   UNL     1       1.479  -2.138   0.266  1.00  0.00           C  
HETATM   17  C   UNL     1       2.666  -2.362   0.941  1.00  0.00           C  
HETATM   18  C   UNL     1       3.653  -1.398   0.945  1.00  0.00           C  
HETATM   19  C   UNL     1       3.449  -0.191   0.275  1.00  0.00           C  
HETATM   20  C   UNL     1       4.502   0.846   0.275  1.00  0.00           C  
HETATM   21  O   UNL     1       4.321   1.896  -0.310  1.00  0.00           O  
HETATM   22  N   UNL     1       5.663   0.627   0.923  1.00  0.00           N  
HETATM   23  C   UNL     1       6.707   1.654   0.923  1.00  0.00           C  
HETATM   24  H   UNL     1      -0.609   1.972  -0.688  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.198   1.783   0.985  1.00  0.00           H  
HETATM   26  H   UNL     1      -2.913   2.982  -0.204  1.00  0.00           H  
HETATM   27  H   UNL     1      -2.831   1.863  -1.582  1.00  0.00           H  
HETATM   28  H   UNL     1      -5.317   2.576  -0.204  1.00  0.00           H  
HETATM   29  H   UNL     1      -7.132   1.258   0.795  1.00  0.00           H  
HETATM   30  H   UNL     1      -6.666  -0.989   1.700  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.382  -1.894   1.608  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.786  -0.782   1.671  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.220  -1.783   0.266  1.00  0.00           H  
HETATM   34  H   UNL     1       2.090   0.955  -0.936  1.00  0.00           H  
HETATM   35  H   UNL     1       0.710  -2.896   0.266  1.00  0.00           H  
HETATM   36  H   UNL     1       2.820  -3.293   1.466  1.00  0.00           H  
HETATM   37  H   UNL     1       4.579  -1.574   1.473  1.00  0.00           H  
HETATM   38  H   UNL     1       5.808  -0.212   1.389  1.00  0.00           H  
HETATM   39  H   UNL     1       7.013   1.862  -0.102  1.00  0.00           H  
HETATM   40  H   UNL     1       6.320   2.566   1.378  1.00  0.00           H  
HETATM   41  H   UNL     1       7.566   1.300   1.494  1.00  0.00           H  
CONECT    1    2   10   24   25                                       
CONECT    2    3    1   26   27                                       
CONECT    3    4    2    8    8                                       
CONECT    4    5    5    3   28                                       
CONECT    5    4    4    6   29                                       
CONECT    6    5    7    7   30                                       
CONECT    7    6    6    8   31                                       
CONECT    8    3    3    7    9                                       
CONECT    9    8   10   32   33                                       
CONECT   10    1    9   11                                            
CONECT   11   10   14   12   12                                       
CONECT   11   13   13                                                 
CONECT   12   11   11                                                 
CONECT   13   11   11                                                 
CONECT   14   15   15   16   11                                       
CONECT   15   19   14   14   34                                       
CONECT   16   17   17   14   35                                       
CONECT   17   18   16   16   36                                       
CONECT   18   19   19   17   37                                       
CONECT   19   20   18   18   15                                       
CONECT   20   22   21   21   19                                       
CONECT   21   20   20                                                 
CONECT   22   23   20   38                                            
CONECT   23   22   39   40   41                                       
CONECT   24    1                                                      
CONECT   25    1                                                      
CONECT   26    2                                                      
CONECT   27    2                                                      
CONECT   28    4                                                      
CONECT   29    5                                                      
CONECT   30    6                                                      
CONECT   31    7                                                      
CONECT   32    9                                                      
CONECT   33    9                                                      
CONECT   34   15                                                      
CONECT   35   16                                                      
CONECT   36   17                                                      
CONECT   37   18                                                      
CONECT   38   22                                                      
CONECT   39   23                                                      
CONECT   40   23                                                      
CONECT   41   23                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
