COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.535   2.600   1.482  1.00  0.00           C  
HETATM    2  C   UNL     1       3.505   2.004   0.131  1.00  0.00           C  
HETATM    3  C   UNL     1       2.490   1.096  -0.237  1.00  0.00           C  
HETATM    4  C   UNL     1       2.492   0.551  -1.527  1.00  0.00           C  
HETATM    5  C   UNL     1       1.376  -0.359  -1.726  1.00  0.00           C  
HETATM    6  C   UNL     1       0.583  -0.504  -0.682  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.634  -1.393  -0.657  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.295  -2.688   0.036  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.368  -2.773   1.415  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.059  -3.958   2.055  1.00  0.00           C  
HETATM   11  C   UNL     1       0.324  -5.063   1.319  1.00  0.00           C  
HETATM   12  C   UNL     1       0.398  -4.981  -0.066  1.00  0.00           C  
HETATM   13  C   UNL     1       0.082  -3.789  -0.706  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.998  -1.094  -0.401  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.043  -0.336   0.420  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.741   1.881   1.096  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.479   3.375   0.888  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.825   3.753  -0.554  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.993   2.896  -1.512  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.269   1.416  -1.235  1.00  0.00           C  
HETATM   21  C   UNL     1       4.411   1.748  -2.072  1.00  0.00           C  
HETATM   22  C   UNL     1       4.477   2.329  -0.817  1.00  0.00           C  
HETATM   23  N   UNL     1       0.786  -6.096  -0.813  1.00  0.00           N  
HETATM   24  N   UNL     1      -3.922   1.104   0.157  1.00  0.00           N  
HETATM   25  N   UNL     1       3.461   0.903  -2.388  1.00  0.00           N  
HETATM   26  O   UNL     1       4.510   3.470   1.813  1.00  0.00           O  
HETATM   27  O   UNL     1       2.679   2.310   2.293  1.00  0.00           O  
HETATM   28  O   UNL     1      -1.689  -0.737   0.048  1.00  0.00           O  
HETATM   29  S   UNL     1       1.122   0.470   0.672  1.00  0.00           S  
HETATM   30  H   UNL     1       1.209  -0.878  -2.658  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.953  -1.601  -1.679  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.667  -1.911   1.992  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.117  -4.021   3.131  1.00  0.00           H  
HETATM   34  H   UNL     1       0.566  -5.989   1.819  1.00  0.00           H  
HETATM   35  H   UNL     1       0.135  -3.724  -1.783  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.145  -2.167  -0.275  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.104  -0.834  -1.454  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.041  -0.674   0.138  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.881  -0.527   1.480  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.482   1.605   2.118  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.796   1.670   0.919  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.098   3.952   1.575  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.427   3.589   1.079  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.885   3.575  -0.733  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.598   4.807  -0.719  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.266   3.131  -2.541  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.934   3.103  -1.360  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.326   1.207  -1.401  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.668   0.803  -1.906  1.00  0.00           H  
HETATM   50  H   UNL     1       5.161   1.997  -2.808  1.00  0.00           H  
HETATM   51  H   UNL     1       5.268   3.023  -0.575  1.00  0.00           H  
HETATM   52  H   UNL     1       1.003  -6.928  -0.365  1.00  0.00           H  
HETATM   53  H   UNL     1       0.837  -6.037  -1.780  1.00  0.00           H  
HETATM   54  H   UNL     1       4.485   3.837   2.707  1.00  0.00           H  
CONECT    1    2   27   27   26                                       
CONECT    2    3    3   22    1                                       
CONECT    3    4   29    2    2                                       
CONECT    4    5   25   25    3                                       
CONECT    5    4    6    6   30                                       
CONECT    6    5    5    7   29                                       
CONECT    7   28    6    8   31                                       
CONECT    8    7   13   13    9                                       
CONECT    9    8   10   10   32                                       
CONECT   10    9    9   11   33                                       
CONECT   11   12   12   10   34                                       
CONECT   12   13   23   11   11                                       
CONECT   13    8    8   12   35                                       
CONECT   14   15   28   36   37                                       
CONECT   15   24   14   38   39                                       
CONECT   16   17   24   40   41                                       
CONECT   17   18   16   42   43                                       
CONECT   18   17   19   44   45                                       
CONECT   19   18   20   46   47                                       
CONECT   20   19   24   48   49                                       
CONECT   21   25   22   22   50                                       
CONECT   22   21   21    2   51                                       
CONECT   23   12   52   53                                            
CONECT   24   16   20   15                                            
CONECT   25    4    4   21                                            
CONECT   26    1   54                                                 
CONECT   27    1    1                                                 
CONECT   28   14    7                                                 
CONECT   29    6    3                                                 
CONECT   30    5                                                      
CONECT   31    7                                                      
CONECT   32    9                                                      
CONECT   33   10                                                      
CONECT   34   11                                                      
CONECT   35   13                                                      
CONECT   36   14                                                      
CONECT   37   14                                                      
CONECT   38   15                                                      
CONECT   39   15                                                      
CONECT   40   16                                                      
CONECT   41   16                                                      
CONECT   42   17                                                      
CONECT   43   17                                                      
CONECT   44   18                                                      
CONECT   45   18                                                      
CONECT   46   19                                                      
CONECT   47   19                                                      
CONECT   48   20                                                      
CONECT   49   20                                                      
CONECT   50   21                                                      
CONECT   51   22                                                      
CONECT   52   23                                                      
CONECT   53   23                                                      
CONECT   54   26                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
