COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -5.774   3.466  -0.679  1.00  0.00           N  
HETATM    2  N   UNL     1      -3.554   2.842  -0.838  1.00  0.00           N  
HETATM    3  C   UNL     1      -3.832   1.599  -0.457  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.163   1.256  -0.166  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.147   2.251  -0.292  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.956  -0.520   0.140  1.00  0.00           C  
HETATM    7  P   UNL     1       0.368  -5.126  -0.083  1.00  0.00           P  
HETATM    8  O   UNL     1       1.727  -5.331   0.467  1.00  0.00           O  
HETATM    9  O   UNL     1      -0.727  -5.546   1.021  1.00  0.00           O  
HETATM   10  O   UNL     1       0.173  -3.576  -0.469  1.00  0.00           O  
HETATM   11  C   UNL     1       0.382  -2.510   0.460  1.00  0.00           C  
HETATM   12  C   UNL     1       0.112  -1.171  -0.230  1.00  0.00           C  
HETATM   13  C   UNL     1       0.437  -0.012   0.732  1.00  0.00           C  
HETATM   14  O   UNL     1       1.475   0.836   0.173  1.00  0.00           O  
HETATM   15  C   UNL     1      -0.895   0.769   0.848  1.00  0.00           C  
HETATM   16  O   UNL     1      -0.662   2.179   0.836  1.00  0.00           O  
HETATM   17  C   UNL     1      -1.647   0.322  -0.432  1.00  0.00           C  
HETATM   18  O   UNL     1      -1.281  -1.068  -0.568  1.00  0.00           O  
HETATM   19  N   UNL     1      -3.094   0.460  -0.255  1.00  0.00           N  
HETATM   20  N   UNL     1      -5.169  -0.051   0.192  1.00  0.00           N  
HETATM   21  C   UNL     1      -4.509   3.741  -0.941  1.00  0.00           C  
HETATM   22  N   UNL     1      -7.475   1.972  -0.019  1.00  0.00           N  
HETATM   23  N   UNL     1       3.686   3.395   1.577  1.00  0.00           N  
HETATM   24  C   UNL     1       3.332   2.422   0.535  1.00  0.00           C  
HETATM   25  C   UNL     1       4.561   1.580   0.185  1.00  0.00           C  
HETATM   26  C   UNL     1       5.630   2.475  -0.444  1.00  0.00           C  
HETATM   27  S   UNL     1       7.087   1.477  -0.859  1.00  0.00           S  
HETATM   28  C   UNL     1       8.223   2.693  -1.581  1.00  0.00           C  
HETATM   29  C   UNL     1       2.234   1.522   1.041  1.00  0.00           C  
HETATM   30  O   UNL     1       2.037   1.418   2.229  1.00  0.00           O  
HETATM   31  O   UNL     1       0.179  -6.035  -1.398  1.00  0.00           O  
HETATM   32  H   UNL     1      -3.673  -1.535   0.376  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.642  -5.437   0.729  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.298  -2.627   1.305  1.00  0.00           H  
HETATM   35  H   UNL     1       1.411  -2.534   0.816  1.00  0.00           H  
HETATM   36  H   UNL     1       0.719  -1.090  -1.131  1.00  0.00           H  
HETATM   37  H   UNL     1       0.739  -0.396   1.705  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.442   0.474   1.743  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.467   2.711   0.906  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.308   0.894  -1.296  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.249   4.742  -1.253  1.00  0.00           H  
HETATM   42  H   UNL     1      -8.145   2.667  -0.109  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.735   1.081   0.263  1.00  0.00           H  
HETATM   44  H   UNL     1       2.909   4.006   1.780  1.00  0.00           H  
HETATM   45  H   UNL     1       4.009   2.930   2.412  1.00  0.00           H  
HETATM   46  H   UNL     1       2.988   2.950  -0.354  1.00  0.00           H  
HETATM   47  H   UNL     1       4.958   1.122   1.092  1.00  0.00           H  
HETATM   48  H   UNL     1       4.278   0.800  -0.521  1.00  0.00           H  
HETATM   49  H   UNL     1       5.233   2.933  -1.350  1.00  0.00           H  
HETATM   50  H   UNL     1       5.913   3.255   0.263  1.00  0.00           H  
HETATM   51  H   UNL     1       7.761   3.145  -2.459  1.00  0.00           H  
HETATM   52  H   UNL     1       8.441   3.467  -0.846  1.00  0.00           H  
HETATM   53  H   UNL     1       9.149   2.197  -1.872  1.00  0.00           H  
HETATM   54  H   UNL     1       0.282  -6.983  -1.240  1.00  0.00           H  
CONECT    1   21    5    5                                            
CONECT    2   21   21    3                                            
CONECT    3    2   19    4    4                                       
CONECT    4    3    3    5   20                                       
CONECT    5    1    1    4   22                                       
CONECT    6   19   20   20   32                                       
CONECT    7    8    8    9   10                                       
CONECT    7   31                                                      
CONECT    8    7    7                                                 
CONECT    9    7   33                                                 
CONECT   10    7   11                                                 
CONECT   11   10   12   34   35                                       
CONECT   12   13   11   18   36                                       
CONECT   13   14   15   12   37                                       
CONECT   14   29   13                                                 
CONECT   15   13   16   17   38                                       
CONECT   16   15   39                                                 
CONECT   17   15   18   19   40                                       
CONECT   18   12   17                                                 
CONECT   19   17    3    6                                            
CONECT   20    6    6    4                                            
CONECT   21    2    2    1   41                                       
CONECT   22    5   42   43                                            
CONECT   23   24   44   45                                            
CONECT   24   25   23   29   46                                       
CONECT   25   26   24   47   48                                       
CONECT   26   25   27   49   50                                       
CONECT   27   26   28                                                 
CONECT   28   27   51   52   53                                       
CONECT   29   30   30   24   14                                       
CONECT   30   29   29                                                 
CONECT   31    7   54                                                 
CONECT   32    6                                                      
CONECT   33    9                                                      
CONECT   34   11                                                      
CONECT   35   11                                                      
CONECT   36   12                                                      
CONECT   37   13                                                      
CONECT   38   15                                                      
CONECT   39   16                                                      
CONECT   40   17                                                      
CONECT   41   21                                                      
CONECT   42   22                                                      
CONECT   43   22                                                      
CONECT   44   23                                                      
CONECT   45   23                                                      
CONECT   46   24                                                      
CONECT   47   25                                                      
CONECT   48   25                                                      
CONECT   49   26                                                      
CONECT   50   26                                                      
CONECT   51   28                                                      
CONECT   52   28                                                      
CONECT   53   28                                                      
CONECT   54   31                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
