COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNK     1       1.952  -0.686   3.714  1.00  0.00           N  
HETATM    2  C   UNK     1       1.558   0.571   3.746  1.00  0.00           C  
HETATM    3  C   UNK     1       1.256   1.251   2.575  1.00  0.00           C  
HETATM    4  C   UNK     1       2.304   2.061  -2.971  1.00  0.00           C  
HETATM    5  O   UNK     1       1.834   2.346  -4.196  1.00  0.00           O  
HETATM    6  C   UNK     1      -6.085  -0.812   0.242  1.00  0.00           C  
HETATM    7  C   UNK     1      -5.010   0.026  -0.454  1.00  0.00           C  
HETATM    8  C   UNK     1      -2.589   0.640  -0.460  1.00  0.00           C  
HETATM    9  C   UNK     1      -1.241   0.416   0.229  1.00  0.00           C  
HETATM   10  C   UNK     1      -3.663  -0.198   0.235  1.00  0.00           C  
HETATM   11  O   UNK     1       3.235   1.301  -2.843  1.00  0.00           O  
HETATM   12  C   UNK     1       1.670   2.688  -1.757  1.00  0.00           C  
HETATM   13  C   UNK     1       2.198   4.114  -1.585  1.00  0.00           C  
HETATM   14  S   UNK     1       1.435   4.869  -0.123  1.00  0.00           S  
HETATM   15  N   UNK     1       2.004   1.898  -0.569  1.00  0.00           N  
HETATM   16  C   UNK     1       1.067   1.260   0.073  1.00  0.00           C  
HETATM   17  C   UNK     1       1.377   0.578   1.350  1.00  0.00           C  
HETATM   18  C   UNK     1       1.799  -0.754   1.370  1.00  0.00           C  
HETATM   19  C   UNK     1       1.948  -1.528   0.085  1.00  0.00           C  
HETATM   20  O   UNK     1       2.388  -2.856   0.376  1.00  0.00           O  
HETATM   21  P   UNK     1       2.653  -3.962  -0.763  1.00  0.00           P  
HETATM   22  O   UNK     1       3.882  -3.493  -1.691  1.00  0.00           O  
HETATM   23  O   UNK     1       3.010  -5.371  -0.071  1.00  0.00           O  
HETATM   24  O   UNK     1       1.438  -4.114  -1.594  1.00  0.00           O  
HETATM   25  C   UNK     1       2.078  -1.352   2.582  1.00  0.00           C  
HETATM   26  C   UNK     1       1.434   1.278   5.071  1.00  0.00           C  
HETATM   27  O   UNK     1       0.850   2.546   2.614  1.00  0.00           O  
HETATM   28  N   UNK     1      -0.213   1.219  -0.437  1.00  0.00           N  
HETATM   29  N   UNK     1      -5.787  -2.239   0.058  1.00  0.00           N  
HETATM   30  C   UNK     1      -7.432  -0.499  -0.356  1.00  0.00           C  
HETATM   31  O   UNK     1      -7.915  -1.241  -1.178  1.00  0.00           O  
HETATM   32  H   UNK     1       2.273   1.919  -4.945  1.00  0.00           H  
HETATM   33  H   UNK     1      -6.096  -0.578   1.306  1.00  0.00           H  
HETATM   34  H   UNK     1      -4.938  -0.271  -1.500  1.00  0.00           H  
HETATM   35  H   UNK     1      -5.278   1.081  -0.394  1.00  0.00           H  
HETATM   36  H   UNK     1      -2.856   1.695  -0.400  1.00  0.00           H  
HETATM   37  H   UNK     1      -2.516   0.343  -1.506  1.00  0.00           H  
HETATM   38  H   UNK     1      -1.314   0.714   1.275  1.00  0.00           H  
HETATM   39  H   UNK     1      -0.974  -0.639   0.169  1.00  0.00           H  
HETATM   40  H   UNK     1      -3.736   0.099   1.281  1.00  0.00           H  
HETATM   41  H   UNK     1      -3.395  -1.253   0.175  1.00  0.00           H  
HETATM   42  H   UNK     1       0.588   2.714  -1.884  1.00  0.00           H  
HETATM   43  H   UNK     1       3.280   4.088  -1.458  1.00  0.00           H  
HETATM   44  H   UNK     1       1.950   4.702  -2.469  1.00  0.00           H  
HETATM   45  H   UNK     1       1.982   6.097  -0.097  1.00  0.00           H  
HETATM   46  H   UNK     1       0.987  -1.568  -0.428  1.00  0.00           H  
HETATM   47  H   UNK     1       2.680  -1.034  -0.554  1.00  0.00           H  
HETATM   48  H   UNK     1       4.713  -3.373  -1.212  1.00  0.00           H  
HETATM   49  H   UNK     1       3.182  -6.085  -0.699  1.00  0.00           H  
HETATM   50  H   UNK     1       2.404  -2.381   2.605  1.00  0.00           H  
HETATM   51  H   UNK     1       0.427   1.140   5.463  1.00  0.00           H  
HETATM   52  H   UNK     1       2.158   0.864   5.773  1.00  0.00           H  
HETATM   53  H   UNK     1       1.628   2.342   4.935  1.00  0.00           H  
HETATM   54  H   UNK     1       1.573   3.186   2.563  1.00  0.00           H  
HETATM   55  H   UNK     1      -0.432   1.722  -1.237  1.00  0.00           H  
HETATM   56  H   UNK     1      -5.771  -2.482  -0.921  1.00  0.00           H  
HETATM   57  H   UNK     1      -4.918  -2.488   0.507  1.00  0.00           H  
HETATM   58  O   UNK     1      -8.095   0.604   0.024  1.00  0.00           O  
HETATM   59  H   UNK     1      -8.955   0.763  -0.388  1.00  0.00           H  
CONECT    1    2   25   25                                            
CONECT    2   26    3    3    1                                       
CONECT    3   27    2    2   17                                       
CONECT    4   11   11    5   12                                       
CONECT    5    4   32                                                 
CONECT    6    7   30   29   33                                       
CONECT    7   10    6   34   35                                       
CONECT    8   10    9   36   37                                       
CONECT    9   28    8   38   39                                       
CONECT   10    7    8   40   41                                       
CONECT   11    4    4                                                 
CONECT   12    4   15   13   42                                       
CONECT   13   12   14   43   44                                       
CONECT   14   13   45                                                 
CONECT   15   16   16   12                                            
CONECT   16   17   15   15   28                                       
CONECT   17    3   16   18   18                                       
CONECT   18   17   17   25   19                                       
CONECT   19   18   20   46   47                                       
CONECT   20   19   21                                                 
CONECT   21   20   24   24   23                                       
CONECT   21   22                                                      
CONECT   22   21   48                                                 
CONECT   23   21   49                                                 
CONECT   24   21   21                                                 
CONECT   25    1    1   18   50                                       
CONECT   26    2   51   52   53                                       
CONECT   27    3   54                                                 
CONECT   28   16    9   55                                            
CONECT   29    6   56   57                                            
CONECT   30    6   31   31   58                                       
CONECT   31   30   30                                                 
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    7                                                      
CONECT   35    7                                                      
CONECT   36    8                                                      
CONECT   37    8                                                      
CONECT   38    9                                                      
CONECT   39    9                                                      
CONECT   40   10                                                      
CONECT   41   10                                                      
CONECT   42   12                                                      
CONECT   43   13                                                      
CONECT   44   13                                                      
CONECT   45   14                                                      
CONECT   46   19                                                      
CONECT   47   19                                                      
CONECT   48   22                                                      
CONECT   49   23                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
CONECT   52   26                                                      
CONECT   53   26                                                      
CONECT   54   27                                                      
CONECT   55   28                                                      
CONECT   56   29                                                      
CONECT   57   29                                                      
CONECT   58   30   59                                                 
CONECT   59   58                                                      
MASTER        0    0    0    0    0    0    0    0   59    0   59    0
END
