COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       2.652  -1.892   1.089  1.00  0.00           N  
HETATM    2  C   UNL     1       3.024   0.401   1.726  1.00  0.00           C  
HETATM    3  C   UNL     1       3.152  -0.628   0.797  1.00  0.00           C  
HETATM    4  C   UNL     1       3.779  -0.394  -0.424  1.00  0.00           C  
HETATM    5  C   UNL     1       0.318  -1.739  -0.360  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.766  -1.856   0.455  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.051  -1.179   1.022  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.068   0.575  -1.158  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.784  -0.104  -1.722  1.00  0.00           C  
HETATM   10  C   UNL     1      -6.370   1.041   0.302  1.00  0.00           C  
HETATM   11  C   UNL     1       4.677   3.227  -0.094  1.00  0.00           C  
HETATM   12  C   UNL     1       4.273   0.851  -0.715  1.00  0.00           C  
HETATM   13  C   UNL     1       4.147   1.887   0.216  1.00  0.00           C  
HETATM   14  C   UNL     1       3.516   1.649   1.441  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.913  -1.085   0.201  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.145  -0.419   0.749  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.156   0.459  -0.340  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.923  -0.197  -0.903  1.00  0.00           C  
HETATM   19  C   UNL     1       0.311  -0.862  -1.442  1.00  0.00           C  
HETATM   20  S   UNL     1       1.754  -2.708  -0.037  1.00  0.00           S  
HETATM   21  O   UNL     1       2.516  -2.707  -1.236  1.00  0.00           O  
HETATM   22  O   UNL     1       1.302  -3.897   0.595  1.00  0.00           O  
HETATM   23  O   UNL     1      -5.264   1.205  -0.588  1.00  0.00           O  
HETATM   24  C   UNL     1      -7.516   1.956  -0.133  1.00  0.00           C  
HETATM   25  C   UNL     1      -8.700   1.780   0.820  1.00  0.00           C  
HETATM   26  O   UNL     1       5.225   3.433  -1.159  1.00  0.00           O  
HETATM   27  O   UNL     1       4.554   4.225   0.804  1.00  0.00           O  
HETATM   28  H   UNL     1       2.834  -2.297   1.952  1.00  0.00           H  
HETATM   29  H   UNL     1       2.533   0.218   2.671  1.00  0.00           H  
HETATM   30  H   UNL     1       3.877  -1.194  -1.142  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.745  -2.537   1.293  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.056  -1.853   1.866  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.089   1.256  -1.996  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.775   0.573  -2.564  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.704   0.003   0.278  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.063   1.299   1.315  1.00  0.00           H  
HETATM   37  H   UNL     1       4.760   1.032  -1.662  1.00  0.00           H  
HETATM   38  H   UNL     1       3.417   2.447   2.162  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.017  -0.494   1.381  1.00  0.00           H  
HETATM   40  H   UNL     1       1.186  -0.785  -2.070  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.181   2.993  -0.109  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.823   1.697  -1.146  1.00  0.00           H  
HETATM   43  H   UNL     1      -9.034   0.742   0.795  1.00  0.00           H  
HETATM   44  H   UNL     1      -8.392   2.039   1.833  1.00  0.00           H  
HETATM   45  H   UNL     1      -9.516   2.432   0.510  1.00  0.00           H  
HETATM   46  H   UNL     1       4.918   5.086   0.557  1.00  0.00           H  
CONECT    1   20    3   28                                            
CONECT    2    3    3   14   29                                       
CONECT    3    1    2    2    4                                       
CONECT    4    3   12   12   30                                       
CONECT    5    6   20   19   19                                       
CONECT    6   15   15    5   31                                       
CONECT    7   16   16   15   32                                       
CONECT    8   17   17   18   33                                       
CONECT    9   18   18   19   34                                       
CONECT   10   23   24   35   36                                       
CONECT   11   13   26   26   27                                       
CONECT   12    4    4   13   37                                       
CONECT   13   14   14   12   11                                       
CONECT   14    2   13   13   38                                       
CONECT   15    7    6    6   18                                       
CONECT   16    7    7   17   39                                       
CONECT   17   16   23    8    8                                       
CONECT   18   15    8    9    9                                       
CONECT   19    5    5    9   40                                       
CONECT   20   22   22   21   21                                       
CONECT   20    5    1                                                 
CONECT   21   20   20                                                 
CONECT   22   20   20                                                 
CONECT   23   17   10                                                 
CONECT   24   10   25   41   42                                       
CONECT   25   24   43   44   45                                       
CONECT   26   11   11                                                 
CONECT   27   11   46                                                 
CONECT   28    1                                                      
CONECT   29    2                                                      
CONECT   30    4                                                      
CONECT   31    6                                                      
CONECT   32    7                                                      
CONECT   33    8                                                      
CONECT   34    9                                                      
CONECT   35   10                                                      
CONECT   36   10                                                      
CONECT   37   12                                                      
CONECT   38   14                                                      
CONECT   39   16                                                      
CONECT   40   19                                                      
CONECT   41   24                                                      
CONECT   42   24                                                      
CONECT   43   25                                                      
CONECT   44   25                                                      
CONECT   45   25                                                      
CONECT   46   27                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
