COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.459  -0.208   0.290  1.00  0.00           C  
HETATM    2  C   UNL     1       4.213  -0.906  -0.257  1.00  0.00           C  
HETATM    3  C   UNL     1       3.014  -0.583   0.635  1.00  0.00           C  
HETATM    4  C   UNL     1       1.767  -1.281   0.088  1.00  0.00           C  
HETATM    5  C   UNL     1       0.568  -0.958   0.981  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.458   0.353  -0.287  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.217  -1.986  -0.711  1.00  0.00           C  
HETATM    8  C   UNL     1       7.905   0.167  -0.056  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.779  -1.372   1.235  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.858   1.829  -0.346  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.601  -0.508  -0.830  1.00  0.00           C  
HETATM   12  O   UNL     1      -2.189  -0.014   1.068  1.00  0.00           O  
HETATM   13  C   UNL     1      -2.895  -2.303   0.753  1.00  0.00           C  
HETATM   14  C   UNL     1       9.105  -0.156  -0.948  1.00  0.00           C  
HETATM   15  C   UNL     1       6.659  -0.531  -0.603  1.00  0.00           C  
HETATM   16  O   UNL     1      -0.596  -1.610   0.470  1.00  0.00           O  
HETATM   17  S   UNL     1      -1.452   2.858   0.158  1.00  0.00           S  
HETATM   18  O   UNL     1      -1.175   2.681   1.541  1.00  0.00           O  
HETATM   19  O   UNL     1      -0.414   2.793  -0.811  1.00  0.00           O  
HETATM   20  O   UNL     1      -1.970   4.285   0.058  1.00  0.00           O  
HETATM   21  O   UNL     1      -3.833  -0.184  -2.202  1.00  0.00           O  
HETATM   22  O   UNL     1      -4.307  -2.800  -1.148  1.00  0.00           O  
HETATM   23  O   UNL     1      -2.466  -3.661   0.864  1.00  0.00           O  
HETATM   24  H   UNL     1       5.296   0.870   0.302  1.00  0.00           H  
HETATM   25  H   UNL     1       5.656  -0.557   1.303  1.00  0.00           H  
HETATM   26  H   UNL     1       4.016  -0.557  -1.271  1.00  0.00           H  
HETATM   27  H   UNL     1       4.377  -1.984  -0.270  1.00  0.00           H  
HETATM   28  H   UNL     1       3.210  -0.932   1.649  1.00  0.00           H  
HETATM   29  H   UNL     1       2.850   0.495   0.648  1.00  0.00           H  
HETATM   30  H   UNL     1       1.571  -0.932  -0.926  1.00  0.00           H  
HETATM   31  H   UNL     1       1.931  -2.359   0.075  1.00  0.00           H  
HETATM   32  H   UNL     1       0.764  -1.307   1.994  1.00  0.00           H  
HETATM   33  H   UNL     1       0.404   0.120   0.993  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.564   0.194  -0.890  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.341  -2.188  -1.329  1.00  0.00           H  
HETATM   36  H   UNL     1       8.102  -0.182   0.958  1.00  0.00           H  
HETATM   37  H   UNL     1       7.742   1.245  -0.043  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.576  -1.564   2.288  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.149   2.085  -1.365  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.697   2.005   0.327  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.506  -0.319  -0.253  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.786  -2.151   1.362  1.00  0.00           H  
HETATM   43  H   UNL     1       8.908   0.193  -1.962  1.00  0.00           H  
HETATM   44  H   UNL     1       9.993   0.342  -0.558  1.00  0.00           H  
HETATM   45  H   UNL     1       9.269  -1.234  -0.961  1.00  0.00           H  
HETATM   46  H   UNL     1       6.823  -1.609  -0.615  1.00  0.00           H  
HETATM   47  H   UNL     1       6.462  -0.182  -1.617  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.546  -0.693  -2.612  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.135  -3.750  -1.093  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.245  -3.931   1.766  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.319   4.958   0.300  1.00  0.00           H  
CONECT    1   15    2   24   25                                       
CONECT    2    1    3   26   27                                       
CONECT    3    2    4   28   29                                       
CONECT    4    3    5   30   31                                       
CONECT    5    4   16   32   33                                       
CONECT    6   12   10   11   34                                       
CONECT    7   11   22   13   35                                       
CONECT    8   14   15   36   37                                       
CONECT    9   16   12   13   38                                       
CONECT   10    6   17   39   40                                       
CONECT   11    6   21    7   41                                       
CONECT   12    9    6                                                 
CONECT   13    7   23    9   42                                       
CONECT   14    8   43   44   45                                       
CONECT   15    8    1   46   47                                       
CONECT   16    5    9                                                 
CONECT   17   10   18   18   19                                       
CONECT   17   19   20                                                 
CONECT   18   17   17                                                 
CONECT   19   17   17                                                 
CONECT   20   17   51                                                 
CONECT   21   11   48                                                 
CONECT   22    7   49                                                 
CONECT   23   13   50                                                 
CONECT   24    1                                                      
CONECT   25    1                                                      
CONECT   26    2                                                      
CONECT   27    2                                                      
CONECT   28    3                                                      
CONECT   29    3                                                      
CONECT   30    4                                                      
CONECT   31    4                                                      
CONECT   32    5                                                      
CONECT   33    5                                                      
CONECT   34    6                                                      
CONECT   35    7                                                      
CONECT   36    8                                                      
CONECT   37    8                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   10                                                      
CONECT   41   11                                                      
CONECT   42   13                                                      
CONECT   43   14                                                      
CONECT   44   14                                                      
CONECT   45   14                                                      
CONECT   46   15                                                      
CONECT   47   15                                                      
CONECT   48   21                                                      
CONECT   49   22                                                      
CONECT   50   23                                                      
CONECT   51   20                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
