COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.609  -1.239   1.028  1.00  0.00           C  
HETATM    2  C   UNL     1       2.473  -1.422   0.019  1.00  0.00           C  
HETATM    3  C   UNL     1       2.392   0.778  -1.242  1.00  0.00           C  
HETATM    4  C   UNL     1       3.486   1.636  -0.603  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.907  -0.386  -0.227  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.725  -1.347  -1.175  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.810  -1.907  -1.847  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.085  -1.510  -1.577  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.311  -0.522  -0.607  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.205   0.043   0.081  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.749   1.402   1.283  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.602  -0.073  -0.286  1.00  0.00           C  
HETATM   13  O   UNL     1       0.362   1.717   0.483  1.00  0.00           O  
HETATM   14  S   UNL     1       0.480   0.307   0.612  1.00  0.00           S  
HETATM   15  O   UNL     1       0.562  -0.354   1.867  1.00  0.00           O  
HETATM   16  N   UNL     1       1.834  -0.129  -0.236  1.00  0.00           N  
HETATM   17  N   UNL     1       4.046   2.546  -1.612  1.00  0.00           N1+
HETATM   18  C   UNL     1       4.276  -2.590   1.295  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.459   1.032   1.049  1.00  0.00           C  
HETATM   20  N   UNL     1      -4.764   0.854   0.629  1.00  0.00           N  
HETATM   21  H   UNL     1       4.344  -0.544   0.624  1.00  0.00           H  
HETATM   22  H   UNL     1       3.206  -0.842   1.960  1.00  0.00           H  
HETATM   23  H   UNL     1       2.875  -1.819  -0.913  1.00  0.00           H  
HETATM   24  H   UNL     1       1.737  -2.118   0.423  1.00  0.00           H  
HETATM   25  H   UNL     1       1.603   1.424  -1.627  1.00  0.00           H  
HETATM   26  H   UNL     1       2.817   0.197  -2.060  1.00  0.00           H  
HETATM   27  H   UNL     1       3.061   2.217   0.214  1.00  0.00           H  
HETATM   28  H   UNL     1       4.275   0.990  -0.218  1.00  0.00           H  
HETATM   29  H   UNL     1       0.275  -1.681  -1.410  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.637  -2.667  -2.595  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.916  -1.952  -2.107  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.951   2.160   2.025  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.461  -0.489  -0.792  1.00  0.00           H  
HETATM   34  H   UNL     1       4.768   3.111  -1.191  1.00  0.00           H  
HETATM   35  H   UNL     1       4.440   2.007  -2.369  1.00  0.00           H  
HETATM   36  H   UNL     1       5.085  -2.459   2.013  1.00  0.00           H  
HETATM   37  H   UNL     1       3.540  -3.285   1.698  1.00  0.00           H  
HETATM   38  H   UNL     1       4.679  -2.987   0.363  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.647   1.491   1.594  1.00  0.00           H  
HETATM   40  H   UNL     1       3.316   3.143  -1.968  1.00  0.00           H  
CONECT    1    2   18   21   22                                       
CONECT    2   16    1   23   24                                       
CONECT    3    4   16   25   26                                       
CONECT    4   17    3   27   28                                       
CONECT    5   10   10    6   14                                       
CONECT    6    7    7    5   29                                       
CONECT    7    8    6    6   30                                       
CONECT    8    9    9    7   31                                       
CONECT    9   12    8    8   10                                       
CONECT   10    9   19    5    5                                       
CONECT   11   20   19   19   32                                       
CONECT   12   20   20    9   33                                       
CONECT   13   14   14                                                 
CONECT   14    5   13   13   16                                       
CONECT   14   15   15                                                 
CONECT   15   14   14                                                 
CONECT   16    3   14    2                                            
CONECT   17    4   34   35   40                                       
CONECT   18    1   36   37   38                                       
CONECT   19   11   11   10   39                                       
CONECT   20   12   12   11                                            
CONECT   21    1                                                      
CONECT   22    1                                                      
CONECT   23    2                                                      
CONECT   24    2                                                      
CONECT   25    3                                                      
CONECT   26    3                                                      
CONECT   27    4                                                      
CONECT   28    4                                                      
CONECT   29    6                                                      
CONECT   30    7                                                      
CONECT   31    8                                                      
CONECT   32   11                                                      
CONECT   33   12                                                      
CONECT   34   17                                                      
CONECT   35   17                                                      
CONECT   36   18                                                      
CONECT   37   18                                                      
CONECT   38   18                                                      
CONECT   39   19                                                      
CONECT   40   17                                                      
MASTER        0    0    0    0    0    0    0    0   40    0   40    0
END
