COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNK     1      -9.992  -2.523  -0.743  1.00  0.00           O  
HETATM    2  C   UNK     1       7.308   1.375  -0.031  1.00  0.00           C  
HETATM    3  C   UNK     1       7.526   0.034  -0.291  1.00  0.00           C  
HETATM    4  O   UNK     1     -11.413  -0.870  -0.316  1.00  0.00           O  
HETATM    5  C   UNK     1       6.464  -0.796  -0.597  1.00  0.00           C  
HETATM    6  N   UNK     1       2.671  -0.437   0.503  1.00  0.00           N  
HETATM    7  C   UNK     1       5.180  -0.289  -0.644  1.00  0.00           C  
HETATM    8  C   UNK     1      -0.776  -0.019   0.479  1.00  0.00           C  
HETATM    9  N   UNK     1       3.660   1.574  -0.430  1.00  0.00           N  
HETATM   10  C   UNK     1      -2.930   0.890   0.048  1.00  0.00           C  
HETATM   11  O   UNK     1      -8.035   1.518   0.250  1.00  0.00           O  
HETATM   12  C   UNK     1      -3.724   1.995   0.331  1.00  0.00           C  
HETATM   13  C   UNK     1      -5.097   1.880   0.315  1.00  0.00           C  
HETATM   14  C   UNK     1      -5.690   0.653   0.013  1.00  0.00           C  
HETATM   15  N   UNK     1       9.431  -1.127   1.321  1.00  0.00           N  
HETATM   16  C   UNK     1      -7.163   0.527  -0.005  1.00  0.00           C  
HETATM   17  C   UNK     1      -9.156  -0.294  -0.193  1.00  0.00           C  
HETATM   18  C   UNK     1     -10.260  -1.242  -0.420  1.00  0.00           C  
HETATM   19  N   UNK     1       1.318   1.126  -0.124  1.00  0.00           N  
HETATM   20  N   UNK     1       1.167  -2.125   1.318  1.00  0.00           N  
HETATM   21  C   UNK     1       1.466  -0.898   0.762  1.00  0.00           C  
HETATM   22  O   UNK     1       9.159  -1.785  -1.042  1.00  0.00           O  
HETATM   23  C   UNK     1       2.581   0.786  -0.032  1.00  0.00           C  
HETATM   24  C   UNK     1      -9.278   1.023   0.137  1.00  0.00           C  
HETATM   25  C   UNK     1      -4.890  -0.455  -0.271  1.00  0.00           C  
HETATM   26  C   UNK     1      -3.517  -0.334  -0.252  1.00  0.00           C  
HETATM   27  C   UNK     1       4.957   1.058  -0.384  1.00  0.00           C  
HETATM   28  C   UNK     1       6.026   1.888  -0.071  1.00  0.00           C  
HETATM   29  N   UNK     1       0.567   0.054   0.384  1.00  0.00           N  
HETATM   30  N   UNK     1      -1.538   1.010   0.060  1.00  0.00           N  
HETATM   31  N   UNK     1      -7.828  -0.568  -0.273  1.00  0.00           N  
HETATM   32  O   UNK     1      10.039   0.479  -0.452  1.00  0.00           O  
HETATM   33  O   UNK     1      -1.299  -1.013   0.942  1.00  0.00           O  
HETATM   34  S   UNK     1       9.162  -0.618  -0.232  1.00  0.00           S  
HETATM   35  H   UNK     1     -10.749  -3.108  -0.882  1.00  0.00           H  
HETATM   36  H   UNK     1       8.140   2.020   0.207  1.00  0.00           H  
HETATM   37  H   UNK     1       6.638  -1.843  -0.800  1.00  0.00           H  
HETATM   38  H   UNK     1       4.351  -0.937  -0.887  1.00  0.00           H  
HETATM   39  H   UNK     1       3.510   2.482  -0.739  1.00  0.00           H  
HETATM   40  H   UNK     1      -3.265   2.944   0.564  1.00  0.00           H  
HETATM   41  H   UNK     1      -5.714   2.739   0.535  1.00  0.00           H  
HETATM   42  H   UNK     1      10.033  -1.869   1.491  1.00  0.00           H  
HETATM   43  H   UNK     1       8.988  -0.683   2.061  1.00  0.00           H  
HETATM   44  H   UNK     1       1.881  -2.737   1.556  1.00  0.00           H  
HETATM   45  H   UNK     1       0.243  -2.375   1.472  1.00  0.00           H  
HETATM   46  H   UNK     1     -10.200   1.566   0.282  1.00  0.00           H  
HETATM   47  H   UNK     1      -5.345  -1.406  -0.504  1.00  0.00           H  
HETATM   48  H   UNK     1      -2.897  -1.191  -0.472  1.00  0.00           H  
HETATM   49  H   UNK     1       5.857   2.935   0.132  1.00  0.00           H  
HETATM   50  H   UNK     1      -1.120   1.835  -0.234  1.00  0.00           H  
CONECT    1   18   35                                                 
CONECT    2   28   28    3   36                                       
CONECT    3    5    5    2   34                                       
CONECT    4   18   18                                                 
CONECT    5    7    3    3   37                                       
CONECT    6   21   21   23                                            
CONECT    7   27   27    5   38                                       
CONECT    8   33   33   29   30                                       
CONECT    9   23   27   39                                            
CONECT   10   26   30   12   12                                       
CONECT   11   24   16                                                 
CONECT   12   10   10   13   40                                       
CONECT   13   14   14   12   41                                       
CONECT   14   25   16   13   13                                       
CONECT   15   34   42   43                                            
CONECT   16   11   14   31   31                                       
CONECT   17   24   24   31   18                                       
CONECT   18   17    4    4    1                                       
CONECT   19   23   23   29                                            
CONECT   20   21   44   45                                            
CONECT   21   20    6    6   29                                       
CONECT   22   34   34                                                 
CONECT   23    6    9   19   19                                       
CONECT   24   11   17   17   46                                       
CONECT   25   26   26   14   47                                       
CONECT   26   25   25   10   48                                       
CONECT   27    9    7    7   28                                       
CONECT   28   27    2    2   49                                       
CONECT   29   21    8   19                                            
CONECT   30    8   10   50                                            
CONECT   31   16   16   17                                            
CONECT   32   34   34                                                 
CONECT   33    8    8                                                 
CONECT   34    3   22   22   32                                       
CONECT   34   32   15                                                 
CONECT   35    1                                                      
CONECT   36    2                                                      
CONECT   37    5                                                      
CONECT   38    7                                                      
CONECT   39    9                                                      
CONECT   40   12                                                      
CONECT   41   13                                                      
CONECT   42   15                                                      
CONECT   43   15                                                      
CONECT   44   20                                                      
CONECT   45   20                                                      
CONECT   46   24                                                      
CONECT   47   25                                                      
CONECT   48   26                                                      
CONECT   49   28                                                      
CONECT   50   30                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
