D03WFI
AUTHOR    GENERATED BY OPEN BABEL 2.4.1
HETATM    1  C   UNL     1       3.205   0.408  -1.826  1.00  0.00           C  
HETATM    2  C   UNL     1       3.602  -0.376  -2.911  1.00  0.00           C  
HETATM    3  C   UNL     1       2.676  -1.388  -3.232  1.00  0.00           C  
HETATM    4  C   UNL     1       2.189  -2.096  -2.121  1.00  0.00           C  
HETATM    5  C   UNL     1       2.308  -1.556  -0.835  1.00  0.00           C  
HETATM    6  C   UNL     1       2.674  -0.220  -0.704  1.00  0.00           C  
HETATM    7  N   UNL     1       2.145  -1.535  -4.518  1.00  0.00           N  
HETATM    8  C   UNL     1       2.849  -0.933  -5.659  1.00  0.00           C  
HETATM    9  C   UNL     1       1.840  -0.444  -6.693  1.00  0.00           C  
HETATM   10  C   UNL     1       1.010  -1.613  -7.200  1.00  0.00           C  
HETATM   11  C   UNL     1       0.215  -2.198  -6.032  1.00  0.00           C  
HETATM   12  C   UNL     1       1.124  -2.560  -4.818  1.00  0.00           C  
HETATM   13  N   UNL     1       4.909  -0.901  -2.604  1.00  0.00           N  
HETATM   14  C   UNL     1       5.968  -1.025  -3.462  1.00  0.00           C  
HETATM   15  C   UNL     1       7.149  -1.641  -2.804  1.00  0.00           C  
HETATM   16  O   UNL     1       5.997  -0.638  -4.624  1.00  0.00           O  
HETATM   17  C   UNL     1       8.415  -1.650  -3.362  1.00  0.00           C  
HETATM   18  S   UNL     1       9.518  -2.474  -2.350  1.00  0.00           S  
HETATM   19  C   UNL     1       8.258  -2.785  -1.221  1.00  0.00           C  
HETATM   20  N   UNL     1       7.082  -2.261  -1.538  1.00  0.00           N  
HETATM   21  C   UNL     1       8.464  -3.598   0.018  1.00  0.00           C  
HETATM   22  C   UNL     1       7.519  -3.916   1.005  1.00  0.00           C  
HETATM   23  N   UNL     1       8.023  -4.685   1.978  1.00  0.00           N  
HETATM   24  N   UNL     1       9.298  -4.876   1.590  1.00  0.00           N  
HETATM   25  C   UNL     1       9.621  -4.228   0.441  1.00  0.00           C  
HETATM   26  C   UNL     1      10.169  -5.720   2.390  1.00  0.00           C  
HETATM   27  N   UNL     1      -0.572  -3.351  -6.505  1.00  0.00           N  
HETATM   28  N   UNL     1       2.796   0.374   0.563  1.00  0.00           N  
HETATM   29  H   UNL     1       3.505   1.453  -1.799  1.00  0.00           H  
HETATM   30  H   UNL     1       1.654  -3.036  -2.237  1.00  0.00           H  
HETATM   31  H   UNL     1       1.996  -2.129   0.032  1.00  0.00           H  
HETATM   32  H   UNL     1       3.517  -1.681  -6.109  1.00  0.00           H  
HETATM   33  H   UNL     1       3.460  -0.072  -5.378  1.00  0.00           H  
HETATM   34  H   UNL     1       2.356   0.041  -7.532  1.00  0.00           H  
HETATM   35  H   UNL     1       1.177   0.311  -6.246  1.00  0.00           H  
HETATM   36  H   UNL     1       1.670  -2.371  -7.641  1.00  0.00           H  
HETATM   37  H   UNL     1       0.335  -1.272  -7.995  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.502  -1.436  -5.697  1.00  0.00           H  
HETATM   39  H   UNL     1       1.627  -3.518  -4.993  1.00  0.00           H  
HETATM   40  H   UNL     1       0.439  -2.692  -3.971  1.00  0.00           H  
HETATM   41  H   UNL     1       5.071  -1.213  -1.651  1.00  0.00           H  
HETATM   42  H   UNL     1       8.727  -1.218  -4.304  1.00  0.00           H  
HETATM   43  H   UNL     1       6.476  -3.619   1.058  1.00  0.00           H  
HETATM   44  H   UNL     1      10.623  -4.287   0.019  1.00  0.00           H  
HETATM   45  H   UNL     1       9.573  -6.269   3.125  1.00  0.00           H  
HETATM   46  H   UNL     1      10.896  -5.083   2.897  1.00  0.00           H  
HETATM   47  H   UNL     1      10.671  -6.425   1.724  1.00  0.00           H  
HETATM   48  H   UNL     1       0.058  -4.063  -6.875  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.152  -3.061  -7.292  1.00  0.00           H  
HETATM   50  H   UNL     1       3.713   0.163   0.957  1.00  0.00           H  
HETATM   51  H   UNL     1       2.706   1.386   0.506  1.00  0.00           H  
CONECT    1    2    6   29                                            
CONECT    2    1    3   13                                            
CONECT    3    2    4    7                                            
CONECT    4    3    5   30                                            
CONECT    5    4    6   31                                            
CONECT    6    5    1   28                                            
CONECT    7    3    8   12                                            
CONECT    8    7    9   32   33                                       
CONECT    9    8   10   34   35                                       
CONECT   10    9   11   36   37                                       
CONECT   11   10   12   27   38                                       
CONECT   12   11    7   39   40                                       
CONECT   13    2   14   41                                            
CONECT   14   13   15   16                                            
CONECT   15   14   17   20                                            
CONECT   16   14                                                      
CONECT   17   15   18   42                                            
CONECT   18   17   19                                                 
CONECT   19   18   20   21                                            
CONECT   20   19   15                                                 
CONECT   21   19   22   25                                            
CONECT   22   21   23   43                                            
CONECT   23   22   24                                                 
CONECT   24   23   25   26                                            
CONECT   25   24   21   44                                            
CONECT   26   24   45   46   47                                       
CONECT   27   11   48   49                                            
CONECT   28    6   50   51                                            
CONECT   29    1                                                      
CONECT   30    4                                                      
CONECT   31    5                                                      
CONECT   32    8                                                      
CONECT   33    8                                                      
CONECT   34    9                                                      
CONECT   35    9                                                      
CONECT   36   10                                                      
CONECT   37   10                                                      
CONECT   38   11                                                      
CONECT   39   12                                                      
CONECT   40   12                                                      
CONECT   41   13                                                      
CONECT   42   17                                                      
CONECT   43   22                                                      
CONECT   44   25                                                      
CONECT   45   26                                                      
CONECT   46   26                                                      
CONECT   47   26                                                      
CONECT   48   27                                                      
CONECT   49   27                                                      
CONECT   50   28                                                      
CONECT   51   28                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END

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