COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -3.167  -0.235  -0.052  1.00  0.00           N  
HETATM    2  C   UNL     1      -5.792  -2.586  -0.383  1.00  0.00           C  
HETATM    3  C   UNL     1      -6.742  -0.503  -0.678  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.481  -0.566  -0.269  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.544  -1.968  -0.196  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.480  -1.397   0.141  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.605   1.117  -0.038  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.660   2.318   0.177  1.00  0.00           C  
HETATM    9  C   UNL     1       0.850   2.200   0.394  1.00  0.00           C  
HETATM   10  C   UNL     1       3.770  -0.145  -0.613  1.00  0.00           C  
HETATM   11  C   UNL     1       4.419  -1.248   0.128  1.00  0.00           C  
HETATM   12  C   UNL     1       5.152  -0.979   1.285  1.00  0.00           C  
HETATM   13  C   UNL     1       5.755  -2.011   1.974  1.00  0.00           C  
HETATM   14  C   UNL     1       5.636  -3.312   1.523  1.00  0.00           C  
HETATM   15  C   UNL     1       4.908  -3.589   0.373  1.00  0.00           C  
HETATM   16  C   UNL     1       4.294  -2.562  -0.323  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.382   2.528   1.527  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.691   1.720   1.382  1.00  0.00           C  
HETATM   19  N   UNL     1      -5.917  -3.963  -0.323  1.00  0.00           N  
HETATM   20  N   UNL     1      -6.851  -1.817  -0.619  1.00  0.00           N  
HETATM   21  N   UNL     1      -5.594   0.119  -0.510  1.00  0.00           N  
HETATM   22  N   UNL     1      -3.290  -2.412   0.056  1.00  0.00           N  
HETATM   23  N   UNL     1       1.525   2.121  -0.903  1.00  0.00           N  
HETATM   24  N   UNL     1       3.887   1.123  -0.171  1.00  0.00           N  
HETATM   25  O   UNL     1      -1.192   1.078  -0.337  1.00  0.00           O  
HETATM   26  O   UNL     1       3.511   2.185  -2.368  1.00  0.00           O  
HETATM   27  O   UNL     1       3.438   3.548  -0.274  1.00  0.00           O  
HETATM   28  O   UNL     1       3.132  -0.382  -1.620  1.00  0.00           O  
HETATM   29  O   UNL     1       4.794  -4.871  -0.066  1.00  0.00           O  
HETATM   30  O   UNL     1      -1.669   3.913   1.730  1.00  0.00           O  
HETATM   31  O   UNL     1      -3.826   2.582   1.492  1.00  0.00           O  
HETATM   32  S   UNL     1       3.161   2.359  -1.001  1.00  0.00           S  
HETATM   33  H   UNL     1      -7.627   0.084  -0.872  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.419  -1.465   0.331  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.126   1.752  -0.754  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.881   3.139  -0.504  1.00  0.00           H  
HETATM   37  H   UNL     1       1.209   3.074   0.938  1.00  0.00           H  
HETATM   38  H   UNL     1       5.248   0.037   1.640  1.00  0.00           H  
HETATM   39  H   UNL     1       6.323  -1.801   2.869  1.00  0.00           H  
HETATM   40  H   UNL     1       6.110  -4.116   2.066  1.00  0.00           H  
HETATM   41  H   UNL     1       3.728  -2.777  -1.217  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.780   2.139   2.347  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.737   0.929   2.131  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.137  -4.513  -0.149  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.784  -4.378  -0.453  1.00  0.00           H  
HETATM   46  H   UNL     1       4.397   1.312   0.632  1.00  0.00           H  
HETATM   47  H   UNL     1       4.031  -5.344   0.294  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.122   4.103   2.563  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.929   2.988   2.363  1.00  0.00           H  
HETATM   50  H   UNL     1       1.065   1.300   0.971  1.00  0.00           H  
HETATM   51  H   UNL     1       1.014   1.929  -1.705  1.00  0.00           H  
CONECT    1    4    6    7                                            
CONECT    2   20   19    5    5                                       
CONECT    3   20   20   21   33                                       
CONECT    4   21   21    5    1                                       
CONECT    5    2    2    4   22                                       
CONECT    6   22   22    1   34                                       
CONECT    7    1   25   18   35                                       
CONECT    8   25   17    9   36                                       
CONECT    9    8   23   37   50                                       
CONECT   10   28   28   11   24                                       
CONECT   11   16   10   12   12                                       
CONECT   12   11   11   13   38                                       
CONECT   13   14   14   12   39                                       
CONECT   14   15   13   13   40                                       
CONECT   15   29   16   16   14                                       
CONECT   16   15   15   11   41                                       
CONECT   17   18    8   30   42                                       
CONECT   18    7   31   17   43                                       
CONECT   19    2   44   45                                            
CONECT   20    3    3    2                                            
CONECT   21    3    4    4                                            
CONECT   22    5    6    6                                            
CONECT   23    9   32   51                                            
CONECT   24   10   32   46                                            
CONECT   25    7    8                                                 
CONECT   26   32   32                                                 
CONECT   27   32   32                                                 
CONECT   28   10   10                                                 
CONECT   29   15   47                                                 
CONECT   30   17   48                                                 
CONECT   31   18   49                                                 
CONECT   32   23   27   27   24                                       
CONECT   32   26   26                                                 
CONECT   33    3                                                      
CONECT   34    6                                                      
CONECT   35    7                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38   12                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   16                                                      
CONECT   42   17                                                      
CONECT   43   18                                                      
CONECT   44   19                                                      
CONECT   45   19                                                      
CONECT   46   24                                                      
CONECT   47   29                                                      
CONECT   48   30                                                      
CONECT   49   31                                                      
CONECT   50    9                                                      
CONECT   51   23                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
