COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.422   0.407   0.534  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.014  -2.215  -0.364  1.00  0.00           C  
HETATM    3  C   UNL     1       0.136   0.317  -0.585  1.00  0.00           C  
HETATM    4  C   UNL     1       2.270   1.380  -0.855  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.139   0.380  -1.532  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.016   0.562  -0.022  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.324   1.853   0.319  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.805   1.757   0.125  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.365   0.442  -0.481  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.885  -0.762   0.298  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.320  -0.629   0.670  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.282  -1.776   0.331  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.673  -1.099   0.491  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.526  -2.016  -0.497  1.00  0.00           C  
HETATM   15  C   UNL     1       0.742  -0.923  -0.527  1.00  0.00           C  
HETATM   16  C   UNL     1       0.896   1.462  -0.751  1.00  0.00           C  
HETATM   17  C   UNL     1       2.889   0.140  -0.790  1.00  0.00           C  
HETATM   18  C   UNL     1       2.126  -1.002  -0.626  1.00  0.00           C  
HETATM   19  O   UNL     1      -6.149   1.278   0.917  1.00  0.00           O  
HETATM   20  O   UNL     1       4.241   0.049  -0.891  1.00  0.00           O  
HETATM   21  O   UNL     1       4.769  -1.198   1.152  1.00  0.00           O  
HETATM   22  O   UNL     1       6.353   0.226   0.141  1.00  0.00           O  
HETATM   23  O   UNL     1       4.275   1.106   1.216  1.00  0.00           O  
HETATM   24  S   UNL     1       4.968   0.135   0.444  1.00  0.00           S  
HETATM   25  H   UNL     1       0.200  -2.627   0.623  1.00  0.00           H  
HETATM   26  H   UNL     1       0.320  -2.922  -1.123  1.00  0.00           H  
HETATM   27  H   UNL     1       2.857   2.277  -0.988  1.00  0.00           H  
HETATM   28  H   UNL     1      -4.918   1.040  -1.915  1.00  0.00           H  
HETATM   29  H   UNL     1      -3.189   0.626  -2.007  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.399  -0.655  -1.754  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.725   2.662  -0.309  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.542   2.118   1.365  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.476   2.583  -0.521  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.308   1.891   1.096  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.712   0.383  -1.513  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.298  -0.812   1.241  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.379  -0.470   1.771  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.135  -2.146  -0.679  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.173  -2.590   1.052  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.139  -1.425   1.420  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.310  -1.349  -0.356  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.789  -1.881  -1.544  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.046  -2.879  -0.085  1.00  0.00           H  
HETATM   44  H   UNL     1       0.417   2.428  -0.806  1.00  0.00           H  
HETATM   45  H   UNL     1       2.611  -1.966  -0.572  1.00  0.00           H  
HETATM   46  H   UNL     1       5.195  -1.251   2.018  1.00  0.00           H  
CONECT    1   19   19    6   13                                       
CONECT    2   15   14   25   26                                       
CONECT    3   16    9   15   15                                       
CONECT    4   16   16   17   27                                       
CONECT    5    6   28   29   30                                       
CONECT    6    7    5    1   11                                       
CONECT    7    8    6   31   32                                       
CONECT    8    7    9   33   34                                       
CONECT    9    8    3   10   35                                       
CONECT   10    9   11   14   36                                       
CONECT   11    6   10   12   37                                       
CONECT   12   11   13   38   39                                       
CONECT   13    1   12   40   41                                       
CONECT   14   10    2   42   43                                       
CONECT   15    3    3   18    2                                       
CONECT   16    4    4    3   44                                       
CONECT   17    4   20   18   18                                       
CONECT   18   17   17   15   45                                       
CONECT   19    1    1                                                 
CONECT   20   24   17                                                 
CONECT   21   24   46                                                 
CONECT   22   24   24                                                 
CONECT   23   24   24                                                 
CONECT   24   23   23   22   22                                       
CONECT   24   21   20                                                 
CONECT   25    2                                                      
CONECT   26    2                                                      
CONECT   27    4                                                      
CONECT   28    5                                                      
CONECT   29    5                                                      
CONECT   30    5                                                      
CONECT   31    7                                                      
CONECT   32    7                                                      
CONECT   33    8                                                      
CONECT   34    8                                                      
CONECT   35    9                                                      
CONECT   36   10                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   12                                                      
CONECT   40   13                                                      
CONECT   41   13                                                      
CONECT   42   14                                                      
CONECT   43   14                                                      
CONECT   44   16                                                      
CONECT   45   18                                                      
CONECT   46   21                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
