COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.339  -0.689   0.422  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.310   0.928   2.410  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.170   0.397   0.128  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.883   0.933  -0.414  1.00  0.00           C  
HETATM    5  C   UNL     1       2.435  -0.071  -0.199  1.00  0.00           C  
HETATM    6  C   UNL     1       1.928   3.165   0.697  1.00  0.00           C  
HETATM    7  C   UNL     1       1.795   2.463  -0.655  1.00  0.00           C  
HETATM    8  C   UNL     1       2.720   1.274  -0.697  1.00  0.00           C  
HETATM    9  C   UNL     1       3.967   1.246  -1.197  1.00  0.00           C  
HETATM   10  C   UNL     1       3.588  -0.836  -0.452  1.00  0.00           C  
HETATM   11  C   UNL     1       2.542  -2.657   0.490  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.113   0.016   2.131  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.522   0.428   1.618  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.948  -0.499  -0.085  1.00  0.00           C  
HETATM   15  N   UNL     1       4.496  -0.011  -1.056  1.00  0.00           N  
HETATM   16  N   UNL     1       3.592  -2.119  -0.091  1.00  0.00           N  
HETATM   17  N   UNL     1       1.442  -1.974   0.750  1.00  0.00           N  
HETATM   18  N   UNL     1       0.183   0.021   0.693  1.00  0.00           N  
HETATM   19  O   UNL     1      -3.279  -0.160  -2.199  1.00  0.00           O  
HETATM   20  O   UNL     1      -3.934  -1.523  -0.269  1.00  0.00           O  
HETATM   21  S   UNL     1      -3.576  -0.260  -0.813  1.00  0.00           S  
HETATM   22  H   UNL     1      -1.540   0.911   3.475  1.00  0.00           H  
HETATM   23  H   UNL     1      -1.071   1.946   2.105  1.00  0.00           H  
HETATM   24  H   UNL     1      -1.944   1.408  -0.214  1.00  0.00           H  
HETATM   25  H   UNL     1      -5.802   0.649  -0.927  1.00  0.00           H  
HETATM   26  H   UNL     1      -5.054   0.939   0.662  1.00  0.00           H  
HETATM   27  H   UNL     1      -4.579   1.928  -0.739  1.00  0.00           H  
HETATM   28  H   UNL     1       1.196   3.971   0.761  1.00  0.00           H  
HETATM   29  H   UNL     1       1.750   2.448   1.498  1.00  0.00           H  
HETATM   30  H   UNL     1       2.932   3.578   0.795  1.00  0.00           H  
HETATM   31  H   UNL     1       0.767   2.127  -0.791  1.00  0.00           H  
HETATM   32  H   UNL     1       2.059   3.157  -1.453  1.00  0.00           H  
HETATM   33  H   UNL     1       4.475   2.088  -1.643  1.00  0.00           H  
HETATM   34  H   UNL     1       2.584  -3.698   0.772  1.00  0.00           H  
HETATM   35  H   UNL     1       0.755   0.377   2.682  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.349  -1.000   2.449  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.786  -0.576   1.950  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.365   1.100   1.779  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.180  -1.512   0.244  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.687  -0.512  -1.143  1.00  0.00           H  
HETATM   41  H   UNL     1       5.383  -0.276  -1.344  1.00  0.00           H  
CONECT    1   17   17    5   18                                       
CONECT    2   12   13   22   23                                       
CONECT    3   14   21   13   24                                       
CONECT    4   21   25   26   27                                       
CONECT    5   10   10    1    8                                       
CONECT    6    7   28   29   30                                       
CONECT    7    8    6   31   32                                       
CONECT    8    5    9    9    7                                       
CONECT    9   15    8    8   33                                       
CONECT   10   16   15    5    5                                       
CONECT   11   16   16   17   34                                       
CONECT   12   18    2   35   36                                       
CONECT   13    3    2   37   38                                       
CONECT   14   18    3   39   40                                       
CONECT   15   10    9   41                                            
CONECT   16   11   11   10                                            
CONECT   17   11    1    1                                            
CONECT   18    1   14   12                                            
CONECT   19   21   21                                                 
CONECT   20   21   21                                                 
CONECT   21   20   20   19   19                                       
CONECT   21    3    4                                                 
CONECT   22    2                                                      
CONECT   23    2                                                      
CONECT   24    3                                                      
CONECT   25    4                                                      
CONECT   26    4                                                      
CONECT   27    4                                                      
CONECT   28    6                                                      
CONECT   29    6                                                      
CONECT   30    6                                                      
CONECT   31    7                                                      
CONECT   32    7                                                      
CONECT   33    9                                                      
CONECT   34   11                                                      
CONECT   35   12                                                      
CONECT   36   12                                                      
CONECT   37   13                                                      
CONECT   38   13                                                      
CONECT   39   14                                                      
CONECT   40   14                                                      
CONECT   41   15                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
