COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -6.689  -2.352  -0.798  1.00  0.00           O  
HETATM    2  C   UNL     1      -1.521   2.925   0.128  1.00  0.00           C  
HETATM    3  C   UNL     1       5.354  -1.151   0.849  1.00  0.00           C  
HETATM    4  C   UNL     1       4.485  -1.668   1.966  1.00  0.00           C  
HETATM    5  C   UNL     1       4.251  -3.168   1.777  1.00  0.00           C  
HETATM    6  C   UNL     1       4.782  -0.610  -0.289  1.00  0.00           C  
HETATM    7  O   UNL     1       3.429  -0.539  -0.424  1.00  0.00           O  
HETATM    8  C   UNL     1       2.803   0.689  -0.047  1.00  0.00           C  
HETATM    9  C   UNL     1       1.301   0.600  -0.322  1.00  0.00           C  
HETATM   10  C   UNL     1       0.630   1.915   0.081  1.00  0.00           C  
HETATM   11  O   UNL     1      -0.773   1.833  -0.176  1.00  0.00           O  
HETATM   12  C   UNL     1      -0.917   4.054   0.663  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.680   5.164   0.971  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.045   5.150   0.748  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.889   2.916  -0.101  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.649   4.026   0.216  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.548   1.694  -0.687  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.877   0.705   0.433  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.535  -0.517  -0.154  1.00  0.00           C  
HETATM   20  O   UNL     1      -4.723  -0.590  -1.349  1.00  0.00           O  
HETATM   21  N   UNL     1      -4.916  -1.529   0.651  1.00  0.00           N  
HETATM   22  S   UNL     1      -5.639  -2.872   0.007  1.00  0.00           S  
HETATM   23  O   UNL     1      -5.917  -3.694   1.132  1.00  0.00           O  
HETATM   24  C   UNL     1      -4.355  -3.624  -1.030  1.00  0.00           C  
HETATM   25  C   UNL     1       5.629  -0.136  -1.299  1.00  0.00           C  
HETATM   26  N   UNL     1       6.943  -0.222  -1.130  1.00  0.00           N  
HETATM   27  C   UNL     1       7.450  -0.748  -0.024  1.00  0.00           C  
HETATM   28  N   UNL     1       6.675  -1.204   0.947  1.00  0.00           N  
HETATM   29  N   UNL     1       8.826  -0.822   0.118  1.00  0.00           N  
HETATM   30  N   UNL     1       5.102   0.414  -2.459  1.00  0.00           N  
HETATM   31  H   UNL     1       4.980  -1.495   2.922  1.00  0.00           H  
HETATM   32  H   UNL     1       3.528  -1.147   1.954  1.00  0.00           H  
HETATM   33  H   UNL     1       3.795  -3.345   0.803  1.00  0.00           H  
HETATM   34  H   UNL     1       5.204  -3.695   1.833  1.00  0.00           H  
HETATM   35  H   UNL     1       3.588  -3.534   2.561  1.00  0.00           H  
HETATM   36  H   UNL     1       2.968   0.870   1.015  1.00  0.00           H  
HETATM   37  H   UNL     1       3.231   1.507  -0.626  1.00  0.00           H  
HETATM   38  H   UNL     1       1.136   0.419  -1.384  1.00  0.00           H  
HETATM   39  H   UNL     1       0.873  -0.218   0.257  1.00  0.00           H  
HETATM   40  H   UNL     1       0.795   2.097   1.143  1.00  0.00           H  
HETATM   41  H   UNL     1       1.058   2.734  -0.498  1.00  0.00           H  
HETATM   42  H   UNL     1       0.148   4.065   0.838  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.210   6.043   1.388  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.639   6.018   0.990  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.715   4.018   0.043  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.467   1.985  -1.196  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.871   1.224  -1.400  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.958   0.414   0.942  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.554   1.176   1.146  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.766  -1.471   1.608  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.050  -2.917  -1.801  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.495  -3.882  -0.413  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.749  -4.526  -1.500  1.00  0.00           H  
HETATM   54  H   UNL     1       9.406  -0.492  -0.586  1.00  0.00           H  
HETATM   55  H   UNL     1       9.211  -1.204   0.923  1.00  0.00           H  
HETATM   56  H   UNL     1       4.141   0.473  -2.575  1.00  0.00           H  
HETATM   57  H   UNL     1       5.695   0.740  -3.154  1.00  0.00           H  
CONECT    1   22   22                                                 
CONECT    2   11   12   15   15                                       
CONECT    3    4    6    6   28                                       
CONECT    4    5    3   31   32                                       
CONECT    5    4   33   34   35                                       
CONECT    6    3    3    7   25                                       
CONECT    7    8    6                                                 
CONECT    8    7    9   36   37                                       
CONECT    9    8   10   38   39                                       
CONECT   10    9   11   40   41                                       
CONECT   11   10    2                                                 
CONECT   12   13   13    2   42                                       
CONECT   13   12   12   14   43                                       
CONECT   14   13   16   16   44                                       
CONECT   15    2    2   16   17                                       
CONECT   16   15   14   14   45                                       
CONECT   17   15   18   46   47                                       
CONECT   18   17   19   48   49                                       
CONECT   19   18   20   20   21                                       
CONECT   20   19   19                                                 
CONECT   21   19   22   50                                            
CONECT   22   21   23   23   24                                       
CONECT   22    1    1                                                 
CONECT   23   22   22                                                 
CONECT   24   22   51   52   53                                       
CONECT   25    6   26   26   30                                       
CONECT   26   27   25   25                                            
CONECT   27   26   28   28   29                                       
CONECT   28   27   27    3                                            
CONECT   29   27   54   55                                            
CONECT   30   25   56   57                                            
CONECT   31    4                                                      
CONECT   32    4                                                      
CONECT   33    5                                                      
CONECT   34    5                                                      
CONECT   35    5                                                      
CONECT   36    8                                                      
CONECT   37    8                                                      
CONECT   38    9                                                      
CONECT   39    9                                                      
CONECT   40   10                                                      
CONECT   41   10                                                      
CONECT   42   12                                                      
CONECT   43   13                                                      
CONECT   44   14                                                      
CONECT   45   16                                                      
CONECT   46   17                                                      
CONECT   47   17                                                      
CONECT   48   18                                                      
CONECT   49   18                                                      
CONECT   50   21                                                      
CONECT   51   24                                                      
CONECT   52   24                                                      
CONECT   53   24                                                      
CONECT   54   29                                                      
CONECT   55   29                                                      
CONECT   56   30                                                      
CONECT   57   30                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
