COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       3.394  -0.876   0.000  1.00  0.00           N  
HETATM    2  C   UNL     1       3.502   2.788   0.018  1.00  0.00           C  
HETATM    3  C   UNL     1       2.667   3.863   0.016  1.00  0.00           C  
HETATM    4  C   UNL     1       3.882   0.326   0.007  1.00  0.00           C  
HETATM    5  C   UNL     1       5.375   0.533   0.012  1.00  0.00           C  
HETATM    6  C   UNL     1       3.737  -3.257  -0.010  1.00  0.00           C  
HETATM    7  C   UNL     1       0.737   2.409  -0.001  1.00  0.00           C  
HETATM    8  C   UNL     1       1.600   1.301   0.006  1.00  0.00           C  
HETATM    9  C   UNL     1       2.977   1.490   0.011  1.00  0.00           C  
HETATM   10  C   UNL     1       4.030  -5.700  -0.021  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.503   2.786  -0.016  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.977   1.489  -0.009  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.601   1.300  -0.004  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.738   2.409  -0.006  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.668   3.862  -0.016  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.276   3.690  -0.011  1.00  0.00           C  
HETATM   17  C   UNL     1       1.275   3.690   0.006  1.00  0.00           C  
HETATM   18  S   UNL     1      -0.001   4.898   0.001  1.00  0.00           S  
HETATM   19  N   UNL     1       4.254  -1.982  -0.003  1.00  0.00           N  
HETATM   20  N   UNL     1       2.445  -3.436  -0.014  1.00  0.00           N  
HETATM   21  N   UNL     1       4.582  -4.342  -0.013  1.00  0.00           N  
HETATM   22  C   UNL     1      -3.882   0.325  -0.006  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.375   0.531  -0.011  1.00  0.00           C  
HETATM   24  N   UNL     1      -3.394  -0.877   0.000  1.00  0.00           N  
HETATM   25  N   UNL     1      -4.254  -1.983   0.003  1.00  0.00           N  
HETATM   26  C   UNL     1      -3.736  -3.258   0.010  1.00  0.00           C  
HETATM   27  N   UNL     1      -2.444  -3.437   0.014  1.00  0.00           N  
HETATM   28  N   UNL     1      -4.580  -4.344   0.013  1.00  0.00           N  
HETATM   29  C   UNL     1      -4.028  -5.701   0.020  1.00  0.00           C  
HETATM   30  H   UNL     1       4.572   2.936   0.021  1.00  0.00           H  
HETATM   31  H   UNL     1       3.081   4.860   0.022  1.00  0.00           H  
HETATM   32  H   UNL     1       5.738   0.588  -1.014  1.00  0.00           H  
HETATM   33  H   UNL     1       5.611   1.462   0.531  1.00  0.00           H  
HETATM   34  H   UNL     1       5.856  -0.301   0.524  1.00  0.00           H  
HETATM   35  H   UNL     1       1.193   0.300   0.010  1.00  0.00           H  
HETATM   36  H   UNL     1       4.846  -6.423  -0.022  1.00  0.00           H  
HETATM   37  H   UNL     1       3.415  -5.847   0.867  1.00  0.00           H  
HETATM   38  H   UNL     1       3.420  -5.839  -0.913  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.573   2.934  -0.020  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.194   0.300   0.002  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.082   4.859  -0.021  1.00  0.00           H  
HETATM   42  H   UNL     1       5.215  -1.849   0.001  1.00  0.00           H  
HETATM   43  H   UNL     1       2.080  -4.334  -0.020  1.00  0.00           H  
HETATM   44  H   UNL     1       5.542  -4.209  -0.010  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.733   0.576  -1.040  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.858  -0.298   0.505  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.615   1.465   0.498  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.215  -1.850   0.000  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.079  -4.335   0.019  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.541  -4.211   0.010  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.418  -5.840   0.912  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.843  -6.424   0.021  1.00  0.00           H  
HETATM   53  H   UNL     1      -3.413  -5.848  -0.868  1.00  0.00           H  
CONECT    1    4    4   19                                            
CONECT    2    3    9    9   30                                       
CONECT    3   17   17    2   31                                       
CONECT    4    9    5    1    1                                       
CONECT    5    4   32   33   34                                       
CONECT    6   19   20   20   21                                       
CONECT    7   17   14    8    8                                       
CONECT    8    7    7    9   35                                       
CONECT    9    2    2    8    4                                       
CONECT   10   21   36   37   38                                       
CONECT   11   15   12   12   39                                       
CONECT   12   11   11   13   22                                       
CONECT   13   14   14   12   40                                       
CONECT   14   16    7   13   13                                       
CONECT   15   16   16   11   41                                       
CONECT   16   18   15   15   14                                       
CONECT   17   18    3    3    7                                       
CONECT   18   16   17                                                 
CONECT   19    1    6   42                                            
CONECT   20    6    6   43                                            
CONECT   21    6   10   44                                            
CONECT   22   12   23   24   24                                       
CONECT   23   22   45   46   47                                       
CONECT   24   22   22   25                                            
CONECT   25   24   26   48                                            
CONECT   26   25   28   27   27                                       
CONECT   27   26   26   49                                            
CONECT   28   26   29   50                                            
CONECT   29   28   51   52   53                                       
CONECT   30    2                                                      
CONECT   31    3                                                      
CONECT   32    5                                                      
CONECT   33    5                                                      
CONECT   34    5                                                      
CONECT   35    8                                                      
CONECT   36   10                                                      
CONECT   37   10                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   13                                                      
CONECT   41   15                                                      
CONECT   42   19                                                      
CONECT   43   20                                                      
CONECT   44   21                                                      
CONECT   45   23                                                      
CONECT   46   23                                                      
CONECT   47   23                                                      
CONECT   48   25                                                      
CONECT   49   27                                                      
CONECT   50   28                                                      
CONECT   51   29                                                      
CONECT   52   29                                                      
CONECT   53   29                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
