COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.403   5.415  -0.980  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.370   4.671   0.285  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.750   3.424   0.403  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.198  -0.720   0.121  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.450  -1.678   0.358  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.385  -4.215  -0.048  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.964  -0.457   0.766  1.00  0.00           C  
HETATM    8  C   UNL     1      -8.149  -1.133   0.067  1.00  0.00           C  
HETATM    9  C   UNL     1       2.793   0.427  -1.043  1.00  0.00           C  
HETATM   10  C   UNL     1       4.437   1.060   0.616  1.00  0.00           C  
HETATM   11  C   UNL     1      -7.310  -0.184   0.621  1.00  0.00           C  
HETATM   12  C   UNL     1      -7.639  -2.351  -0.336  1.00  0.00           C  
HETATM   13  C   UNL     1      -6.287  -2.623  -0.196  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.764  -3.959  -0.659  1.00  0.00           C  
HETATM   15  O   UNL     1      -3.572  -3.054  -0.255  1.00  0.00           O  
HETATM   16  C   UNL     1      -3.977  -1.940   0.539  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.700   0.183   1.029  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.936  -0.439  -1.162  1.00  0.00           C  
HETATM   19  S   UNL     1      -2.038   1.005  -1.300  1.00  0.00           S  
HETATM   20  C   UNL     1      -2.023   1.220   0.445  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.386   2.329   1.159  1.00  0.00           C  
HETATM   22  O   UNL     1      -1.382   2.346   2.377  1.00  0.00           O  
HETATM   23  N   UNL     1      -0.769   5.622  -0.410  1.00  0.00           N  
HETATM   24  N   UNL     1       1.032   4.261  -0.895  1.00  0.00           N  
HETATM   25  C   UNL     1       0.502   3.245  -0.221  1.00  0.00           C  
HETATM   26  N   UNL     1       1.165   2.038  -0.134  1.00  0.00           N  
HETATM   27  C   UNL     1       2.514   1.902  -0.688  1.00  0.00           C  
HETATM   28  C   UNL     1       3.560   2.304   0.367  1.00  0.00           C  
HETATM   29  O   UNL     1       5.801   1.441   0.808  1.00  0.00           O  
HETATM   30  C   UNL     1       4.285   0.221  -0.681  1.00  0.00           C  
HETATM   31  C   UNL     1       4.580  -1.256  -0.409  1.00  0.00           C  
HETATM   32  O   UNL     1       5.960  -1.411  -0.071  1.00  0.00           O  
HETATM   33  S   UNL     1       6.368  -2.848   0.221  1.00  0.00           S  
HETATM   34  O   UNL     1       7.694  -2.793   0.728  1.00  0.00           O  
HETATM   35  O   UNL     1       5.287  -3.435   0.933  1.00  0.00           O  
HETATM   36  N   UNL     1       6.454  -3.638  -1.231  1.00  0.00           N  
HETATM   37  H   UNL     1       0.861   6.218  -1.539  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.329   4.853   0.746  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.487  -4.401   1.021  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.927  -5.080  -0.528  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.309   0.284   1.200  1.00  0.00           H  
HETATM   42  H   UNL     1      -9.202  -0.924  -0.046  1.00  0.00           H  
HETATM   43  H   UNL     1       2.161  -0.235  -0.450  1.00  0.00           H  
HETATM   44  H   UNL     1       2.631   0.254  -2.107  1.00  0.00           H  
HETATM   45  H   UNL     1       4.071   0.501   1.477  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.706   0.768   0.940  1.00  0.00           H  
HETATM   47  H   UNL     1      -8.295  -3.093  -0.768  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.685  -3.961  -1.746  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.451  -4.746  -0.345  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.775  -2.155   1.588  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.830   0.086   2.096  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.250  -1.047  -1.998  1.00  0.00           H  
HETATM   53  H   UNL     1       0.737   1.280   0.294  1.00  0.00           H  
HETATM   54  H   UNL     1       2.618   2.526  -1.575  1.00  0.00           H  
HETATM   55  H   UNL     1       3.063   2.601   1.291  1.00  0.00           H  
HETATM   56  H   UNL     1       4.172   3.124  -0.008  1.00  0.00           H  
HETATM   57  H   UNL     1       5.954   1.967   1.604  1.00  0.00           H  
HETATM   58  H   UNL     1       4.933   0.604  -1.468  1.00  0.00           H  
HETATM   59  H   UNL     1       3.961  -1.604   0.418  1.00  0.00           H  
HETATM   60  H   UNL     1       4.357  -1.841  -1.301  1.00  0.00           H  
HETATM   61  H   UNL     1       7.077  -4.373  -1.347  1.00  0.00           H  
HETATM   62  H   UNL     1       5.883  -3.366  -1.966  1.00  0.00           H  
CONECT    1   24   24   23   37                                       
CONECT    2   23   23    3   38                                       
CONECT    3   25   25    2   21                                       
CONECT    4   17   16   18   18                                       
CONECT    5   13   13    7   16                                       
CONECT    6   14   15   39   40                                       
CONECT    7   11   11    5   41                                       
CONECT    8   12   12   11   42                                       
CONECT    9   30   27   43   44                                       
CONECT   10   29   30   28   45                                       
CONECT   11    8    7    7   46                                       
CONECT   12    8    8   13   47                                       
CONECT   13   12   14    5    5                                       
CONECT   14   13    6   48   49                                       
CONECT   15    6   16                                                 
CONECT   16    5   15    4   50                                       
CONECT   17   20   20    4   51                                       
CONECT   18    4    4   19   52                                       
CONECT   19   20   18                                                 
CONECT   20   21   17   17   19                                       
CONECT   21    3   22   22   20                                       
CONECT   22   21   21                                                 
CONECT   23    1    2    2                                            
CONECT   24    1    1   25                                            
CONECT   25   24   26    3    3                                       
CONECT   26   27   25   53                                            
CONECT   27   28    9   26   54                                       
CONECT   28   10   27   55   56                                       
CONECT   29   10   57                                                 
CONECT   30   10   31    9   58                                       
CONECT   31   32   30   59   60                                       
CONECT   32   33   31                                                 
CONECT   33   34   34   32   35                                       
CONECT   33   35   36                                                 
CONECT   34   33   33                                                 
CONECT   35   33   33                                                 
CONECT   36   33   61   62                                            
CONECT   37    1                                                      
CONECT   38    2                                                      
CONECT   39    6                                                      
CONECT   40    6                                                      
CONECT   41    7                                                      
CONECT   42    8                                                      
CONECT   43    9                                                      
CONECT   44    9                                                      
CONECT   45   10                                                      
CONECT   46   11                                                      
CONECT   47   12                                                      
CONECT   48   14                                                      
CONECT   49   14                                                      
CONECT   50   16                                                      
CONECT   51   17                                                      
CONECT   52   18                                                      
CONECT   53   26                                                      
CONECT   54   27                                                      
CONECT   55   28                                                      
CONECT   56   28                                                      
CONECT   57   29                                                      
CONECT   58   30                                                      
CONECT   59   31                                                      
CONECT   60   31                                                      
CONECT   61   36                                                      
CONECT   62   36                                                      
MASTER        0    0    0    0    0    0    0    0   62    0   62    0
END
