COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -2.611  -0.398   0.977  1.00  0.00           O  
HETATM    2  C   UNL     1      -1.463  -0.753   1.145  1.00  0.00           C  
HETATM    3  N   UNL     1      -0.643  -0.879   2.269  1.00  0.00           N  
HETATM    4  CA  UNL     1      -0.264   0.372   2.934  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.064   0.515   4.204  1.00  0.00           C  
HETATM    6  O   UNL     1      -1.351   1.736   4.682  1.00  0.00           O  
HETATM    7  OXT UNL     1      -1.447  -0.468   4.791  1.00  0.00           O  
HETATM    8  C   UNL     1       1.255   0.414   3.255  1.00  0.00           C  
HETATM    9  C   UNL     1       1.583  -0.367   4.529  1.00  0.00           C  
HETATM   10  C   UNL     1       1.773   1.851   3.335  1.00  0.00           C  
HETATM   11  S   UNL     1       1.881  -0.451   1.746  1.00  0.00           S  
HETATM   12  C   UNL     1       0.428  -1.548   1.493  1.00  0.00           C  
HETATM   13  CA  UNL     1      -0.369  -1.247   0.223  1.00  0.00           C  
HETATM   14  N   UNL     1       0.222  -0.198  -0.610  1.00  0.00           N  
HETATM   15  C   UNL     1       0.047  -0.219  -1.946  1.00  0.00           C  
HETATM   16  O   UNL     1      -0.599  -1.108  -2.458  1.00  0.00           O  
HETATM   17  C   UNL     1       0.656   0.859  -2.803  1.00  0.00           C  
HETATM   18  C   UNL     1       0.314   0.605  -4.249  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.836   1.144  -4.792  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.149   0.911  -6.118  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.311   0.139  -6.901  1.00  0.00           C  
HETATM   22  C   UNL     1       0.840  -0.398  -6.358  1.00  0.00           C  
HETATM   23  C   UNL     1       1.155  -0.161  -5.033  1.00  0.00           C  
HETATM   24  HA  UNL     1      -0.492   1.209   2.274  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.864   1.829   5.496  1.00  0.00           H  
HETATM   26  H   UNL     1       2.663  -0.386   4.676  1.00  0.00           H  
HETATM   27  H   UNL     1       1.108   0.113   5.383  1.00  0.00           H  
HETATM   28  H   UNL     1       1.212  -1.388   4.434  1.00  0.00           H  
HETATM   29  H   UNL     1       2.854   1.840   3.478  1.00  0.00           H  
HETATM   30  H   UNL     1       1.534   2.375   2.410  1.00  0.00           H  
HETATM   31  H   UNL     1       1.300   2.362   4.174  1.00  0.00           H  
HETATM   32  H   UNL     1       0.603  -2.602   1.709  1.00  0.00           H  
HETATM   33  HA  UNL     1      -0.642  -2.137  -0.344  1.00  0.00           H  
HETATM   34  H   UNL     1       0.740   0.512  -0.200  1.00  0.00           H  
HETATM   35  H   UNL     1       0.260   1.829  -2.501  1.00  0.00           H  
HETATM   36  H   UNL     1       1.739   0.855  -2.679  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.491   1.747  -4.181  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.049   1.331  -6.543  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.556  -0.043  -7.937  1.00  0.00           H  
HETATM   40  H   UNL     1       1.495  -1.001  -6.969  1.00  0.00           H  
HETATM   41  H   UNL     1       2.055  -0.582  -4.608  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3   13                                       
CONECT    3    2    4   12                                            
CONECT    4    3    5    8   24                                       
CONECT    5    4    6    7    7                                       
CONECT    6    5   25                                                 
CONECT    7    5    5                                                 
CONECT    8    4    9   10   11                                       
CONECT    9    8   26   27   28                                       
CONECT   10    8   29   30   31                                       
CONECT   11    8   12                                                 
CONECT   12    3   11   13   32                                       
CONECT   13    2   12   14   33                                       
CONECT   14   13   15   34                                            
CONECT   15   14   16   16   17                                       
CONECT   16   15   15                                                 
CONECT   17   15   18   35   36                                       
CONECT   18   17   19   19   23                                       
CONECT   19   18   18   20   37                                       
CONECT   20   19   21   21   38                                       
CONECT   21   20   20   22   39                                       
CONECT   22   21   23   23   40                                       
CONECT   23   18   22   22   41                                       
CONECT   24    4                                                      
CONECT   25    6                                                      
CONECT   26    9                                                      
CONECT   27    9                                                      
CONECT   28    9                                                      
CONECT   29   10                                                      
CONECT   30   10                                                      
CONECT   31   10                                                      
CONECT   32   12                                                      
CONECT   33   13                                                      
CONECT   34   14                                                      
CONECT   35   17                                                      
CONECT   36   17                                                      
CONECT   37   19                                                      
CONECT   38   20                                                      
CONECT   39   21                                                      
CONECT   40   22                                                      
CONECT   41   23                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
