COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -3.040   2.956  -0.631  1.00  0.00           N  
HETATM    2  C   UNL     1      -3.846   1.955   0.079  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.675   0.611  -0.582  1.00  0.00           C  
HETATM    4  O   UNL     1      -3.270   0.544  -1.723  1.00  0.00           O  
HETATM    5  C   UNL     1      -5.321   2.362   0.033  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.515   3.664   0.811  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.962   4.137   0.662  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.207   3.424   2.291  1.00  0.00           C  
HETATM    9  C   UNL     1       6.062   0.495  -0.075  1.00  0.00           C  
HETATM   10  C   UNL     1       1.858  -1.351  -0.118  1.00  0.00           C  
HETATM   11  C   UNL     1       6.034   1.879   0.011  1.00  0.00           C  
HETATM   12  C   UNL     1       1.823  -1.996   1.291  1.00  0.00           C  
HETATM   13  C   UNL     1       7.328   2.652   0.037  1.00  0.00           C  
HETATM   14  C   UNL     1       4.836   2.553   0.073  1.00  0.00           C  
HETATM   15  C   UNL     1       0.754  -3.102   1.114  1.00  0.00           C  
HETATM   16  C   UNL     1       3.633   1.839   0.049  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.060  -2.648  -0.113  1.00  0.00           C  
HETATM   18  C   UNL     1       3.661   0.439  -0.038  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.532  -2.484   0.271  1.00  0.00           C  
HETATM   20  C   UNL     1       4.882  -0.229  -0.105  1.00  0.00           C  
HETATM   21  C   UNL     1       1.571   1.149   0.042  1.00  0.00           C  
HETATM   22  N   UNL     1      -3.972  -0.516   0.095  1.00  0.00           N  
HETATM   23  N   UNL     1       4.916  -1.624  -0.192  1.00  0.00           N  
HETATM   24  N   UNL     1       2.340   0.031  -0.040  1.00  0.00           N  
HETATM   25  N   UNL     1       2.327   2.207   0.094  1.00  0.00           N  
HETATM   26  O   UNL     1      -4.142  -2.965   0.340  1.00  0.00           O  
HETATM   27  O   UNL     1       3.092  -2.561   1.625  1.00  0.00           O  
HETATM   28  O   UNL     1       7.714   2.979  -1.299  1.00  0.00           O  
HETATM   29  O   UNL     1      -4.410  -1.896  -1.903  1.00  0.00           O  
HETATM   30  O   UNL     1       1.377  -4.364   0.865  1.00  0.00           O  
HETATM   31  O   UNL     1       0.478  -1.385  -0.539  1.00  0.00           O  
HETATM   32  O   UNL     1      -2.297  -2.177  -0.897  1.00  0.00           O  
HETATM   33  S   UNL     1      -3.784  -1.992  -0.631  1.00  0.00           S  
HETATM   34  H   UNL     1      -2.056   2.744  -0.560  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.324   3.032  -1.597  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.519   1.894   1.117  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.625   2.509  -1.004  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.929   1.576   0.481  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.841   4.426   0.419  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.636   3.375   1.054  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.101   5.065   1.216  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.181   4.307  -0.392  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.881   2.663   2.683  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.176   3.088   2.398  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.345   4.352   2.846  1.00  0.00           H  
HETATM   46  H   UNL     1       7.010  -0.021  -0.123  1.00  0.00           H  
HETATM   47  H   UNL     1       2.482  -1.936  -0.793  1.00  0.00           H  
HETATM   48  H   UNL     1       1.512  -1.271   2.043  1.00  0.00           H  
HETATM   49  H   UNL     1       7.192   3.569   0.611  1.00  0.00           H  
HETATM   50  H   UNL     1       8.105   2.045   0.501  1.00  0.00           H  
HETATM   51  H   UNL     1       4.824   3.631   0.139  1.00  0.00           H  
HETATM   52  H   UNL     1       0.115  -3.160   1.995  1.00  0.00           H  
HETATM   53  H   UNL     1       0.037  -3.381  -0.914  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.898  -3.412   0.711  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.631  -1.675   0.994  1.00  0.00           H  
HETATM   56  H   UNL     1       0.491   1.158   0.061  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.297  -0.462   1.008  1.00  0.00           H  
HETATM   58  H   UNL     1       4.088  -2.129  -0.205  1.00  0.00           H  
HETATM   59  H   UNL     1       5.767  -2.086  -0.239  1.00  0.00           H  
HETATM   60  H   UNL     1       3.120  -2.977   2.497  1.00  0.00           H  
HETATM   61  H   UNL     1       8.540   3.478  -1.359  1.00  0.00           H  
HETATM   62  H   UNL     1       1.947  -4.669   1.584  1.00  0.00           H  
CONECT    1    2   34   35                                            
CONECT    2    5    1    3   36                                       
CONECT    3    2   22    4    4                                       
CONECT    4    3    3                                                 
CONECT    5    6    2   37   38                                       
CONECT    6    8    5    7   39                                       
CONECT    7    6   40   41   42                                       
CONECT    8    6   43   44   45                                       
CONECT    9   20   11   11   46                                       
CONECT   10   31   12   24   47                                       
CONECT   11    9    9   14   13                                       
CONECT   12   15   10   27   48                                       
CONECT   13   11   28   49   50                                       
CONECT   14   16   16   11   51                                       
CONECT   15   30   17   12   52                                       
CONECT   16   18   25   14   14                                       
CONECT   17   15   31   19   53                                       
CONECT   18   24   20   20   16                                       
CONECT   19   17   32   54   55                                       
CONECT   20   23   18   18    9                                       
CONECT   21   24   25   25   56                                       
CONECT   22    3   33   57                                            
CONECT   23   20   58   59                                            
CONECT   24   10   21   18                                            
CONECT   25   21   21   16                                            
CONECT   26   33   33                                                 
CONECT   27   12   60                                                 
CONECT   28   13   61                                                 
CONECT   29   33   33                                                 
CONECT   30   15   62                                                 
CONECT   31   17   10                                                 
CONECT   32   19   33                                                 
CONECT   33   32   22   29   29                                       
CONECT   33   26   26                                                 
CONECT   34    1                                                      
CONECT   35    1                                                      
CONECT   36    2                                                      
CONECT   37    5                                                      
CONECT   38    5                                                      
CONECT   39    6                                                      
CONECT   40    7                                                      
CONECT   41    7                                                      
CONECT   42    7                                                      
CONECT   43    8                                                      
CONECT   44    8                                                      
CONECT   45    8                                                      
CONECT   46    9                                                      
CONECT   47   10                                                      
CONECT   48   12                                                      
CONECT   49   13                                                      
CONECT   50   13                                                      
CONECT   51   14                                                      
CONECT   52   15                                                      
CONECT   53   17                                                      
CONECT   54   19                                                      
CONECT   55   19                                                      
CONECT   56   21                                                      
CONECT   57   22                                                      
CONECT   58   23                                                      
CONECT   59   23                                                      
CONECT   60   27                                                      
CONECT   61   28                                                      
CONECT   62   30                                                      
MASTER        0    0    0    0    0    0    0    0   62    0   62    0
END
