COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -2.948  -1.275  -0.364  1.00  0.00           N  
HETATM    2  C   UNL     1      -4.098  -0.710   0.053  1.00  0.00           C  
HETATM    3  O   UNL     1       5.639  -0.445   0.502  1.00  0.00           O  
HETATM    4  C   UNL     1      -3.898  -3.494  -0.393  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.477  -5.409  -0.179  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.370  -4.584  -0.092  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.522  -3.213  -0.160  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.316  -2.315  -0.065  1.00  0.00           C  
HETATM    9  C   UNL     1       2.045  -2.451   0.192  1.00  0.00           C  
HETATM   10  O   UNL     1      -5.014  -1.410   0.443  1.00  0.00           O  
HETATM   11  C   UNL     1      -4.245   0.747   0.038  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.393   1.442   0.336  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.106   2.813   0.201  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.783   2.938  -0.177  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.385   4.269  -0.341  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.322   5.181  -0.112  1.00  0.00           C  
HETATM   17  S   UNL     1      -5.832   4.410   0.345  1.00  0.00           S  
HETATM   18  N   UNL     1      -3.254   1.655  -0.270  1.00  0.00           N  
HETATM   19  C   UNL     1      -1.876   1.324  -0.638  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.789  -2.663  -0.305  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.739  -4.865  -0.330  1.00  0.00           C  
HETATM   22  O   UNL     1       0.860  -3.111   0.091  1.00  0.00           O  
HETATM   23  C   UNL     1       3.225  -3.162   0.345  1.00  0.00           C  
HETATM   24  C   UNL     1       4.428  -2.491   0.448  1.00  0.00           C  
HETATM   25  C   UNL     1       4.455  -1.105   0.399  1.00  0.00           C  
HETATM   26  C   UNL     1       3.275  -0.394   0.247  1.00  0.00           C  
HETATM   27  C   UNL     1       2.072  -1.065   0.137  1.00  0.00           C  
HETATM   28  C   UNL     1       5.593   0.982   0.444  1.00  0.00           C  
HETATM   29  C   UNL     1       7.010   1.544   0.575  1.00  0.00           C  
HETATM   30  C   UNL     1       7.855   1.155  -0.653  1.00  0.00           C  
HETATM   31  N   UNL     1       8.246   2.413  -1.326  1.00  0.00           N  
HETATM   32  C   UNL     1       8.224   3.460  -0.273  1.00  0.00           C  
HETATM   33  C   UNL     1       6.977   3.090   0.569  1.00  0.00           C  
HETATM   34  H   UNL     1      -2.231  -0.719  -0.709  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.885  -3.069  -0.506  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.355  -6.481  -0.125  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.386  -5.012   0.030  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.234  -1.719  -0.974  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.423  -1.653   0.794  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.343   1.014   0.620  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.381   4.537  -0.635  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.176   6.248  -0.195  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.839   1.040  -1.690  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.237   2.191  -0.473  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.526   0.493  -0.025  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.601  -5.512  -0.397  1.00  0.00           H  
HETATM   47  H   UNL     1       3.204  -4.242   0.384  1.00  0.00           H  
HETATM   48  H   UNL     1       5.347  -3.046   0.567  1.00  0.00           H  
HETATM   49  H   UNL     1       3.296   0.686   0.208  1.00  0.00           H  
HETATM   50  H   UNL     1       1.153  -0.511   0.018  1.00  0.00           H  
HETATM   51  H   UNL     1       5.165   1.293  -0.510  1.00  0.00           H  
HETATM   52  H   UNL     1       4.976   1.359   1.259  1.00  0.00           H  
HETATM   53  H   UNL     1       7.478   1.178   1.488  1.00  0.00           H  
HETATM   54  H   UNL     1       8.745   0.612  -0.334  1.00  0.00           H  
HETATM   55  H   UNL     1       7.264   0.540  -1.331  1.00  0.00           H  
HETATM   56  H   UNL     1       7.606   2.637  -2.073  1.00  0.00           H  
HETATM   57  H   UNL     1       9.127   3.412   0.336  1.00  0.00           H  
HETATM   58  H   UNL     1       8.112   4.449  -0.716  1.00  0.00           H  
HETATM   59  H   UNL     1       6.067   3.454   0.091  1.00  0.00           H  
HETATM   60  H   UNL     1       7.065   3.482   1.582  1.00  0.00           H  
CONECT    1   20    2   34                                            
CONECT    2   10   10    1   11                                       
CONECT    3   25   28                                                 
CONECT    4   21   20   20   35                                       
CONECT    5   21   21    6   36                                       
CONECT    6    5    7    7   37                                       
CONECT    7    6    6   20    8                                       
CONECT    8    7   22   38   39                                       
CONECT    9   22   27   27   23                                       
CONECT   10    2    2                                                 
CONECT   11    2   18   12   12                                       
CONECT   12   11   11   13   40                                       
CONECT   13   12   14   14   17                                       
CONECT   14   18   13   13   15                                       
CONECT   15   14   16   16   41                                       
CONECT   16   15   15   17   42                                       
CONECT   17   13   16                                                 
CONECT   18   19   11   14                                            
CONECT   19   18   43   44   45                                       
CONECT   20    4    4    7    1                                       
CONECT   21    5    5    4   46                                       
CONECT   22    8    9                                                 
CONECT   23    9   24   24   47                                       
CONECT   24   23   23   25   48                                       
CONECT   25   26   26   24    3                                       
CONECT   26   27   25   25   49                                       
CONECT   27    9    9   26   50                                       
CONECT   28    3   29   51   52                                       
CONECT   29   28   33   30   53                                       
CONECT   30   29   31   54   55                                       
CONECT   31   32   30   56                                            
CONECT   32   33   31   57   58                                       
CONECT   33   29   32   59   60                                       
CONECT   34    1                                                      
CONECT   35    4                                                      
CONECT   36    5                                                      
CONECT   37    6                                                      
CONECT   38    8                                                      
CONECT   39    8                                                      
CONECT   40   12                                                      
CONECT   41   15                                                      
CONECT   42   16                                                      
CONECT   43   19                                                      
CONECT   44   19                                                      
CONECT   45   19                                                      
CONECT   46   21                                                      
CONECT   47   23                                                      
CONECT   48   24                                                      
CONECT   49   26                                                      
CONECT   50   27                                                      
CONECT   51   28                                                      
CONECT   52   28                                                      
CONECT   53   29                                                      
CONECT   54   30                                                      
CONECT   55   30                                                      
CONECT   56   31                                                      
CONECT   57   32                                                      
CONECT   58   32                                                      
CONECT   59   33                                                      
CONECT   60   33                                                      
MASTER        0    0    0    0    0    0    0    0   60    0   60    0
END
