COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       7.582   1.911   2.051  1.00  0.00           O  
HETATM    2  O   UNL     1       5.711  -1.828   0.193  1.00  0.00           O  
HETATM    3  C   UNL     1       5.583  -0.797  -0.432  1.00  0.00           C  
HETATM    4  C   UNL     1       6.793  -0.113  -1.014  1.00  0.00           C  
HETATM    5  C   UNL     1       7.119   1.134  -0.190  1.00  0.00           C  
HETATM    6  C   UNL     1       5.983   2.150  -0.331  1.00  0.00           C  
HETATM    7  C   UNL     1       7.277   0.747   1.281  1.00  0.00           C  
HETATM    8  C   UNL     1       8.423   1.754  -0.697  1.00  0.00           C  
HETATM    9  O   UNL     1       7.906  -1.008  -0.984  1.00  0.00           O  
HETATM   10  N   UNL     1       4.358  -0.263  -0.607  1.00  0.00           N  
HETATM   11  C   UNL     1       3.171  -0.982  -0.136  1.00  0.00           C  
HETATM   12  C   UNL     1       1.919  -0.163  -0.456  1.00  0.00           C  
HETATM   13  C   UNL     1       0.698  -0.903   0.029  1.00  0.00           C  
HETATM   14  O   UNL     1       0.818  -1.978   0.576  1.00  0.00           O  
HETATM   15  N   UNL     1      -0.527  -0.368  -0.146  1.00  0.00           N  
HETATM   16  C   UNL     1      -1.713  -1.087   0.325  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.966  -0.269   0.005  1.00  0.00           C  
HETATM   18  S   UNL     1      -4.432  -1.157   0.587  1.00  0.00           S  
HETATM   19  C   UNL     1      -5.654  -0.053   0.117  1.00  0.00           C  
HETATM   20  O   UNL     1      -5.355   0.981  -0.443  1.00  0.00           O  
HETATM   21  C   UNL     1      -7.101  -0.366   0.399  1.00  0.00           C  
HETATM   22  C   UNL     1      -7.488  -1.668  -0.305  1.00  0.00           C  
HETATM   23  C   UNL     1      -7.966   0.757  -0.110  1.00  0.00           C  
HETATM   24  O   UNL     1      -7.613   1.406  -1.066  1.00  0.00           O  
HETATM   25  C   UNL     1      -9.272   1.071   0.572  1.00  0.00           C  
HETATM   26  C   UNL     1      -9.949   2.246  -0.137  1.00  0.00           C  
HETATM   27  H   UNL     1       7.696   1.740   2.996  1.00  0.00           H  
HETATM   28  H   UNL     1       6.587   0.176  -2.045  1.00  0.00           H  
HETATM   29  H   UNL     1       5.788   2.332  -1.388  1.00  0.00           H  
HETATM   30  H   UNL     1       5.084   1.756   0.142  1.00  0.00           H  
HETATM   31  H   UNL     1       6.269   3.084   0.152  1.00  0.00           H  
HETATM   32  H   UNL     1       8.086   0.023   1.382  1.00  0.00           H  
HETATM   33  H   UNL     1       6.348   0.305   1.643  1.00  0.00           H  
HETATM   34  H   UNL     1       8.685   2.609  -0.075  1.00  0.00           H  
HETATM   35  H   UNL     1       9.220   1.012  -0.650  1.00  0.00           H  
HETATM   36  H   UNL     1       8.292   2.081  -1.729  1.00  0.00           H  
HETATM   37  H   UNL     1       8.147  -1.308  -0.096  1.00  0.00           H  
HETATM   38  H   UNL     1       4.262   0.597  -1.044  1.00  0.00           H  
HETATM   39  H   UNL     1       3.110  -1.949  -0.635  1.00  0.00           H  
HETATM   40  H   UNL     1       3.241  -1.133   0.941  1.00  0.00           H  
HETATM   41  H   UNL     1       1.980   0.804   0.043  1.00  0.00           H  
HETATM   42  H   UNL     1       1.848  -0.012  -1.533  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.623   0.492  -0.584  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.774  -2.054  -0.174  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.643  -1.238   1.402  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.905   0.698   0.504  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.036  -0.118  -1.072  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.245  -0.477   1.474  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.861  -2.481   0.064  1.00  0.00           H  
HETATM   50  H   UNL     1      -8.534  -1.895  -0.101  1.00  0.00           H  
HETATM   51  H   UNL     1      -7.343  -1.557  -1.380  1.00  0.00           H  
HETATM   52  H   UNL     1      -9.923   0.198   0.531  1.00  0.00           H  
HETATM   53  H   UNL     1      -9.084   1.335   1.613  1.00  0.00           H  
HETATM   54  H   UNL     1     -10.894   2.473   0.357  1.00  0.00           H  
HETATM   55  H   UNL     1      -9.299   3.119  -0.096  1.00  0.00           H  
HETATM   56  H   UNL     1     -10.137   1.982  -1.178  1.00  0.00           H  
CONECT    1    7   27                                                 
CONECT    2    3    3                                                 
CONECT    3    4   10    2    2                                       
CONECT    4    5    9    3   28                                       
CONECT    5    7    6    8    4                                       
CONECT    6    5   29   30   31                                       
CONECT    7    1    5   32   33                                       
CONECT    8    5   34   35   36                                       
CONECT    9    4   37                                                 
CONECT   10   11    3   38                                            
CONECT   11   10   12   39   40                                       
CONECT   12   11   13   41   42                                       
CONECT   13   15   12   14   14                                       
CONECT   14   13   13                                                 
CONECT   15   16   13   43                                            
CONECT   16   17   15   44   45                                       
CONECT   17   18   16   46   47                                       
CONECT   18   19   17                                                 
CONECT   19   21   18   20   20                                       
CONECT   20   19   19                                                 
CONECT   21   22   23   19   48                                       
CONECT   22   21   49   50   51                                       
CONECT   23   21   25   24   24                                       
CONECT   24   23   23                                                 
CONECT   25   26   23   52   53                                       
CONECT   26   25   54   55   56                                       
CONECT   27    1                                                      
CONECT   28    4                                                      
CONECT   29    6                                                      
CONECT   30    6                                                      
CONECT   31    6                                                      
CONECT   32    7                                                      
CONECT   33    7                                                      
CONECT   34    8                                                      
CONECT   35    8                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   11                                                      
CONECT   41   12                                                      
CONECT   42   12                                                      
CONECT   43   15                                                      
CONECT   44   16                                                      
CONECT   45   16                                                      
CONECT   46   17                                                      
CONECT   47   17                                                      
CONECT   48   21                                                      
CONECT   49   22                                                      
CONECT   50   22                                                      
CONECT   51   22                                                      
CONECT   52   25                                                      
CONECT   53   25                                                      
CONECT   54   26                                                      
CONECT   55   26                                                      
CONECT   56   26                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
