D0CR2E
AUTHOR    GENERATED BY OPEN BABEL 2.4.1
HETATM    1  S   UNL     1       5.023  -2.440   0.701  1.00  0.00           S  
HETATM    2  N   UNL     1       5.553  -2.253  -0.928  1.00  0.00           N  
HETATM    3  C   UNL     1       4.614  -1.467  -1.629  1.00  0.00           C  
HETATM    4  N   UNL     1       3.471  -1.260  -0.915  1.00  0.00           N  
HETATM    5  C   UNL     1       3.614  -1.426   0.432  1.00  0.00           C  
HETATM    6  C   UNL     1       5.980  -3.414  -1.685  1.00  0.00           C  
HETATM    7  C   UNL     1       7.255  -4.088  -1.272  1.00  0.00           C  
HETATM    8  C   UNL     1       8.070  -3.716  -0.201  1.00  0.00           C  
HETATM    9  C   UNL     1       8.909  -4.662   0.379  1.00  0.00           C  
HETATM   10  C   UNL     1       8.795  -5.996   0.004  1.00  0.00           C  
HETATM   11  C   UNL     1       7.981  -6.327  -1.055  1.00  0.00           C  
HETATM   12  C   UNL     1       7.498  -5.314  -1.893  1.00  0.00           C  
HETATM   13  C   UNL     1       2.220  -1.811  -1.440  1.00  0.00           C  
HETATM   14  C   UNL     1       1.883  -1.599  -2.916  1.00  0.00           C  
HETATM   15  O   UNL     1       2.906  -0.984   1.322  1.00  0.00           O  
HETATM   16  O   UNL     1       4.811  -1.067  -2.777  1.00  0.00           O  
HETATM   17  O   UNL     1       2.719  -2.371  -3.770  1.00  0.00           O  
HETATM   18  H   UNL     1       5.167  -4.162  -1.598  1.00  0.00           H  
HETATM   19  H   UNL     1       6.038  -3.172  -2.755  1.00  0.00           H  
HETATM   20  H   UNL     1       7.979  -2.731   0.255  1.00  0.00           H  
HETATM   21  H   UNL     1       9.499  -4.385   1.254  1.00  0.00           H  
HETATM   22  H   UNL     1       9.236  -6.775   0.607  1.00  0.00           H  
HETATM   23  H   UNL     1       7.438  -7.278  -1.058  1.00  0.00           H  
HETATM   24  H   UNL     1       8.181  -5.159  -2.767  1.00  0.00           H  
HETATM   25  H   UNL     1       1.399  -1.435  -0.823  1.00  0.00           H  
HETATM   26  H   UNL     1       2.284  -2.899  -1.262  1.00  0.00           H  
HETATM   27  H   UNL     1       1.926  -0.541  -3.192  1.00  0.00           H  
HETATM   28  H   UNL     1       0.869  -1.966  -3.094  1.00  0.00           H  
HETATM   29  H   UNL     1       3.089  -1.755  -4.431  1.00  0.00           H  
CONECT    1    2    5                                                 
CONECT    2    1    3    6                                            
CONECT    3    2    4   16                                            
CONECT    4    3    5   13                                            
CONECT    5    4    1   15                                            
CONECT    6    2    7   18   19                                       
CONECT    7    6    8   12                                            
CONECT    8    7    9   20                                            
CONECT    9    8   10   21                                            
CONECT   10    9   11   22                                            
CONECT   11   10   12   23                                            
CONECT   12   11    7   24                                            
CONECT   13    4   14   25   26                                       
CONECT   14   13   17   27   28                                       
CONECT   15    5                                                      
CONECT   16    3                                                      
CONECT   17   14   29                                                 
CONECT   18    6                                                      
CONECT   19    6                                                      
CONECT   20    8                                                      
CONECT   21    9                                                      
CONECT   22   10                                                      
CONECT   23   11                                                      
CONECT   24   12                                                      
CONECT   25   13                                                      
CONECT   26   13                                                      
CONECT   27   14                                                      
CONECT   28   14                                                      
CONECT   29   17                                                      
MASTER        0    0    0    0    0    0    0    0   29    0   29    0
END
M  END

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