D0V1XY
AUTHOR    GENERATED BY OPEN BABEL 2.4.1
HETATM    1  N   UNL     1       2.027  -2.772  -4.379  1.00  0.00           N  
HETATM    2  C   UNL     1       2.328  -3.875  -3.458  1.00  0.00           C  
HETATM    3  C   UNL     1       1.790  -5.266  -3.831  1.00  0.00           C  
HETATM    4  N   UNL     1       1.617  -5.443  -5.198  1.00  0.00           N  
HETATM    5  C   UNL     1       2.308  -4.474  -6.106  1.00  0.00           C  
HETATM    6  C   UNL     1       1.889  -3.015  -5.728  1.00  0.00           C  
HETATM    7  C   UNL     1       1.789  -1.509  -3.719  1.00  0.00           C  
HETATM    8  C   UNL     1       1.369  -1.995  -2.337  1.00  0.00           C  
HETATM    9  C   UNL     1       1.474  -3.478  -2.239  1.00  0.00           C  
HETATM   10  C   UNL     1       2.957  -0.467  -3.486  1.00  0.00           C  
HETATM   11  C   UNL     1       2.671   0.379  -2.218  1.00  0.00           C  
HETATM   12  C   UNL     1       1.424   0.284  -1.685  1.00  0.00           C  
HETATM   13  C   UNL     1       1.059  -1.104  -1.389  1.00  0.00           C  
HETATM   14  O   UNL     1       4.238  -1.072  -3.293  1.00  0.00           O  
HETATM   15  O   UNL     1       1.511  -2.167  -6.537  1.00  0.00           O  
HETATM   16  C   UNL     1       2.104  -4.718  -7.619  1.00  0.00           C  
HETATM   17  O   UNL     1       2.850  -5.824  -8.130  1.00  0.00           O  
HETATM   18  C   UNL     1       0.348  -6.057  -5.516  1.00  0.00           C  
HETATM   19  O   UNL     1       1.589  -6.152  -3.001  1.00  0.00           O  
HETATM   20  S   UNL     1       4.200  -4.527  -5.651  1.00  0.00           S  
HETATM   21  S   UNL     1       4.138  -4.117  -3.566  1.00  0.00           S  
HETATM   22  H   UNL     1       0.969  -1.003  -4.240  1.00  0.00           H  
HETATM   23  H   UNL     1       0.450  -3.872  -2.374  1.00  0.00           H  
HETATM   24  H   UNL     1       1.856  -3.838  -1.286  1.00  0.00           H  
HETATM   25  H   UNL     1       3.059   0.200  -4.347  1.00  0.00           H  
HETATM   26  H   UNL     1       3.464   0.174  -1.483  1.00  0.00           H  
HETATM   27  H   UNL     1       0.613   0.759  -2.251  1.00  0.00           H  
HETATM   28  H   UNL     1       0.703  -1.373  -0.406  1.00  0.00           H  
HETATM   29  H   UNL     1       4.131  -1.842  -2.711  1.00  0.00           H  
HETATM   30  H   UNL     1       2.376  -3.838  -8.212  1.00  0.00           H  
HETATM   31  H   UNL     1       1.048  -4.913  -7.842  1.00  0.00           H  
HETATM   32  H   UNL     1       3.794  -5.581  -8.068  1.00  0.00           H  
HETATM   33  H   UNL     1       0.407  -6.599  -6.455  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.414  -5.271  -5.552  1.00  0.00           H  
HETATM   35  H   UNL     1       0.051  -6.756  -4.724  1.00  0.00           H  
CONECT    1    2    6    7                                            
CONECT    2    1    3    9   21                                       
CONECT    3    2    4   19                                            
CONECT    4    3    5   18                                            
CONECT    5    4    6   16   20                                       
CONECT    6    5    1   15                                            
CONECT    7    1    8   10   22                                       
CONECT    8    7    9   13                                            
CONECT    9    8    2   23   24                                       
CONECT   10    7   11   14   25                                       
CONECT   11   10   12   26                                            
CONECT   12   11   13   27                                            
CONECT   13   12    8   28                                            
CONECT   14   10   29                                                 
CONECT   15    6                                                      
CONECT   16    5   17   30   31                                       
CONECT   17   16   32                                                 
CONECT   18    4   33   34   35                                       
CONECT   19    3                                                      
CONECT   20    5   21                                                 
CONECT   21   20    2                                                 
CONECT   22    7                                                      
CONECT   23    9                                                      
CONECT   24    9                                                      
CONECT   25   10                                                      
CONECT   26   11                                                      
CONECT   27   12                                                      
CONECT   28   13                                                      
CONECT   29   14                                                      
CONECT   30   16                                                      
CONECT   31   16                                                      
CONECT   32   17                                                      
CONECT   33   18                                                      
CONECT   34   18                                                      
CONECT   35   18                                                      
MASTER        0    0    0    0    0    0    0    0   35    0   35    0
END
M  END

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