COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.485  -1.944   0.111  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.503   0.996   2.259  1.00  0.00           C  
HETATM    3  C   UNL     1       0.086   0.530  -0.651  1.00  0.00           C  
HETATM    4  C   UNL     1       2.403   0.533  -0.153  1.00  0.00           C  
HETATM    5  C   UNL     1       4.657   0.604   0.331  1.00  0.00           C  
HETATM    6  C   UNL     1       3.497  -1.476   0.140  1.00  0.00           C  
HETATM    7  C   UNL     1       4.682  -0.786   0.368  1.00  0.00           C  
HETATM    8  C   UNL     1       5.677   2.741   0.502  1.00  0.00           C  
HETATM    9  C   UNL     1       2.218  -3.465  -0.077  1.00  0.00           C  
HETATM   10  N   UNL     1      -2.869  -0.534   0.010  1.00  0.00           N  
HETATM   11  N   UNL     1      -1.059   1.192  -0.912  1.00  0.00           N  
HETATM   12  N   UNL     1       1.223   1.215  -0.422  1.00  0.00           N  
HETATM   13  N   UNL     1       3.510   1.223   0.070  1.00  0.00           N  
HETATM   14  N   UNL     1       2.389  -0.790  -0.120  1.00  0.00           N  
HETATM   15  O   UNL     1      -4.330  -0.920   1.918  1.00  0.00           O  
HETATM   16  O   UNL     1      -4.554   1.135   0.558  1.00  0.00           O  
HETATM   17  O   UNL     1      -2.043  -0.584  -2.315  1.00  0.00           O  
HETATM   18  O   UNL     1      -3.449   1.320  -1.512  1.00  0.00           O  
HETATM   19  O   UNL     1       0.092  -0.685  -0.622  1.00  0.00           O  
HETATM   20  O   UNL     1       5.786   1.317   0.558  1.00  0.00           O  
HETATM   21  O   UNL     1       3.476  -2.831   0.167  1.00  0.00           O  
HETATM   22  S   UNL     1      -3.746   0.174   1.224  1.00  0.00           S  
HETATM   23  S   UNL     1      -2.427   0.352  -1.317  1.00  0.00           S  
HETATM   24  H   UNL     1      -1.518  -2.022   0.607  1.00  0.00           H  
HETATM   25  H   UNL     1      -3.235  -2.485   0.688  1.00  0.00           H  
HETATM   26  H   UNL     1      -2.417  -2.374  -0.888  1.00  0.00           H  
HETATM   27  H   UNL     1      -1.803   0.254   2.643  1.00  0.00           H  
HETATM   28  H   UNL     1      -1.964   1.732   1.664  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.998   1.494   3.093  1.00  0.00           H  
HETATM   30  H   UNL     1       5.599  -1.316   0.581  1.00  0.00           H  
HETATM   31  H   UNL     1       5.335   3.040  -0.489  1.00  0.00           H  
HETATM   32  H   UNL     1       4.960   3.080   1.251  1.00  0.00           H  
HETATM   33  H   UNL     1       6.650   3.189   0.702  1.00  0.00           H  
HETATM   34  H   UNL     1       2.341  -4.547  -0.027  1.00  0.00           H  
HETATM   35  H   UNL     1       1.498  -3.146   0.676  1.00  0.00           H  
HETATM   36  H   UNL     1       1.857  -3.186  -1.067  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.081   2.161  -0.863  1.00  0.00           H  
HETATM   38  H   UNL     1       1.219   2.185  -0.445  1.00  0.00           H  
CONECT    1   10   24   25   26                                       
CONECT    2   22   27   28   29                                       
CONECT    3   11   12   19   19                                       
CONECT    4   14   12   13   13                                       
CONECT    5    7    7   13   20                                       
CONECT    6   21   14   14    7                                       
CONECT    7    6    5    5   30                                       
CONECT    8   20   31   32   33                                       
CONECT    9   21   34   35   36                                       
CONECT   10   22    1   23                                            
CONECT   11   23    3   37                                            
CONECT   12    3    4   38                                            
CONECT   13    4    4    5                                            
CONECT   14    6    6    4                                            
CONECT   15   22   22                                                 
CONECT   16   22   22                                                 
CONECT   17   23   23                                                 
CONECT   18   23   23                                                 
CONECT   19    3    3                                                 
CONECT   20    5    8                                                 
CONECT   21    9    6                                                 
CONECT   22    2   15   15   16                                       
CONECT   22   16   10                                                 
CONECT   23   10   18   18   11                                       
CONECT   23   17   17                                                 
CONECT   24    1                                                      
CONECT   25    1                                                      
CONECT   26    1                                                      
CONECT   27    2                                                      
CONECT   28    2                                                      
CONECT   29    2                                                      
CONECT   30    7                                                      
CONECT   31    8                                                      
CONECT   32    8                                                      
CONECT   33    8                                                      
CONECT   34    9                                                      
CONECT   35    9                                                      
CONECT   36    9                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
MASTER        0    0    0    0    0    0    0    0   38    0   38    0
END
