COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.857  -1.412  -0.327  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.307  -2.703  -0.261  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.181  -3.801  -0.343  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.668  -1.293  -0.099  1.00  0.00           C  
HETATM    5  N   UNL     1      -5.482  -3.567  -0.480  1.00  0.00           N  
HETATM    6  N   UNL     1      -5.173  -1.276  -0.464  1.00  0.00           N  
HETATM    7  C   UNL     1       3.786  -3.172   0.859  1.00  0.00           C  
HETATM    8  C   UNL     1       4.455  -4.238   1.432  1.00  0.00           C  
HETATM    9  C   UNL     1       5.793  -4.444   1.156  1.00  0.00           C  
HETATM   10  C   UNL     1       6.464  -3.584   0.307  1.00  0.00           C  
HETATM   11  C   UNL     1       5.796  -2.518  -0.267  1.00  0.00           C  
HETATM   12  C   UNL     1       4.456  -2.316   0.005  1.00  0.00           C  
HETATM   13  C   UNL     1       3.727  -1.153  -0.620  1.00  0.00           C  
HETATM   14  N   UNL     1       2.381  -1.579  -1.024  1.00  0.00           N  
HETATM   15  C   UNL     1       3.619  -0.014   0.396  1.00  0.00           C  
HETATM   16  C   UNL     1       3.001   1.191  -0.266  1.00  0.00           C  
HETATM   17  O   UNL     1       2.679   1.143  -1.434  1.00  0.00           O  
HETATM   18  N   UNL     1       2.806   2.322   0.442  1.00  0.00           N  
HETATM   19  S   UNL     1       2.127   3.646  -0.285  1.00  0.00           S  
HETATM   20  O   UNL     1       2.026   4.646   0.719  1.00  0.00           O  
HETATM   21  O   UNL     1       2.829   3.838  -1.506  1.00  0.00           O  
HETATM   22  O   UNL     1       0.701   3.271  -0.663  1.00  0.00           O  
HETATM   23  C   UNL     1      -0.201   3.227   0.444  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.597   2.842  -0.051  1.00  0.00           C  
HETATM   25  O   UNL     1      -1.586   1.491  -0.542  1.00  0.00           O  
HETATM   26  C   UNL     1      -2.600   2.896   1.118  1.00  0.00           C  
HETATM   27  O   UNL     1      -3.637   3.841   0.843  1.00  0.00           O  
HETATM   28  C   UNL     1      -3.178   1.462   1.188  1.00  0.00           C  
HETATM   29  O   UNL     1      -4.586   1.491   1.433  1.00  0.00           O  
HETATM   30  C   UNL     1      -2.874   0.919  -0.231  1.00  0.00           C  
HETATM   31  N   UNL     1      -2.800  -0.544  -0.219  1.00  0.00           N  
HETATM   32  N   UNL     1      -1.967  -2.559  -0.123  1.00  0.00           N  
HETATM   33  C   UNL     1      -5.952  -2.334  -0.538  1.00  0.00           C  
HETATM   34  N   UNL     1      -3.697  -5.096  -0.284  1.00  0.00           N  
HETATM   35  H   UNL     1      -0.669  -0.895   0.004  1.00  0.00           H  
HETATM   36  H   UNL     1       2.741  -3.011   1.075  1.00  0.00           H  
HETATM   37  H   UNL     1       3.931  -4.910   2.095  1.00  0.00           H  
HETATM   38  H   UNL     1       6.315  -5.276   1.604  1.00  0.00           H  
HETATM   39  H   UNL     1       7.510  -3.744   0.092  1.00  0.00           H  
HETATM   40  H   UNL     1       6.320  -1.846  -0.930  1.00  0.00           H  
HETATM   41  H   UNL     1       4.277  -0.809  -1.496  1.00  0.00           H  
HETATM   42  H   UNL     1       2.425  -2.287  -1.742  1.00  0.00           H  
HETATM   43  H   UNL     1       1.851  -1.904  -0.229  1.00  0.00           H  
HETATM   44  H   UNL     1       2.994  -0.331   1.231  1.00  0.00           H  
HETATM   45  H   UNL     1       4.613   0.242   0.762  1.00  0.00           H  
HETATM   46  H   UNL     1       3.064   2.360   1.376  1.00  0.00           H  
HETATM   47  H   UNL     1       0.145   2.487   1.166  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.242   4.207   0.919  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.910   3.522  -0.843  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.090   3.148   2.047  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.328   3.874   1.519  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.665   0.873   1.948  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.831   1.905   2.271  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.627   1.260  -0.942  1.00  0.00           H  
HETATM   55  H   UNL     1      -7.016  -2.189  -0.649  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.310  -5.846  -0.342  1.00  0.00           H  
HETATM   57  H   UNL     1      -2.745  -5.254  -0.184  1.00  0.00           H  
CONECT    1    2    2    6   31                                       
CONECT    2    3   32    1    1                                       
CONECT    3   34    5    5    2                                       
CONECT    4   32   32   31   35                                       
CONECT    5    3    3   33                                            
CONECT    6   33   33    1                                            
CONECT    7    8    8   12   36                                       
CONECT    8    9    7    7   37                                       
CONECT    9   10   10    8   38                                       
CONECT   10    9    9   11   39                                       
CONECT   11   10   12   12   40                                       
CONECT   12   11   11    7   13                                       
CONECT   13   12   14   15   41                                       
CONECT   14   13   42   43                                            
CONECT   15   13   16   44   45                                       
CONECT   16   15   18   17   17                                       
CONECT   17   16   16                                                 
CONECT   18   16   19   46                                            
CONECT   19   18   22   20   20                                       
CONECT   19   21   21                                                 
CONECT   20   19   19                                                 
CONECT   21   19   19                                                 
CONECT   22   23   19                                                 
CONECT   23   24   22   47   48                                       
CONECT   24   26   23   25   49                                       
CONECT   25   30   24                                                 
CONECT   26   27   28   24   50                                       
CONECT   27   26   51                                                 
CONECT   28   26   30   29   52                                       
CONECT   29   28   53                                                 
CONECT   30   31   28   25   54                                       
CONECT   31    1    4   30                                            
CONECT   32    2    4    4                                            
CONECT   33    5    6    6   55                                       
CONECT   34    3   56   57                                            
CONECT   35    4                                                      
CONECT   36    7                                                      
CONECT   37    8                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   11                                                      
CONECT   41   13                                                      
CONECT   42   14                                                      
CONECT   43   14                                                      
CONECT   44   15                                                      
CONECT   45   15                                                      
CONECT   46   18                                                      
CONECT   47   23                                                      
CONECT   48   23                                                      
CONECT   49   24                                                      
CONECT   50   26                                                      
CONECT   51   27                                                      
CONECT   52   28                                                      
CONECT   53   29                                                      
CONECT   54   30                                                      
CONECT   55   33                                                      
CONECT   56   34                                                      
CONECT   57   34                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
