COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       5.946  -1.034   1.706  1.00  0.00           O  
HETATM    2  C   UNL     1       5.752  -1.423   0.569  1.00  0.00           C  
HETATM    3  N   UNL     1       6.703  -2.130  -0.073  1.00  0.00           N  
HETATM    4  C   UNL     1       7.970  -2.430   0.598  1.00  0.00           C  
HETATM    5  C   UNL     1       4.475  -1.125  -0.103  1.00  0.00           C  
HETATM    6  N   UNL     1       4.127  -1.495  -1.361  1.00  0.00           N  
HETATM    7  C   UNL     1       2.927  -1.059  -1.615  1.00  0.00           C  
HETATM    8  C   UNL     1       3.427  -0.433   0.430  1.00  0.00           C  
HETATM    9  N   UNL     1       2.459  -0.390  -0.526  1.00  0.00           N  
HETATM   10  C   UNL     1       1.204   0.226  -0.408  1.00  0.00           C  
HETATM   11  C   UNL     1       0.051  -0.514  -0.611  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.190   0.105  -0.491  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.448  -0.635  -0.697  1.00  0.00           C  
HETATM   14  O   UNL     1      -2.437  -1.818  -0.979  1.00  0.00           O  
HETATM   15  N   UNL     1      -3.614   0.034  -0.564  1.00  0.00           N  
HETATM   16  N   UNL     1      -4.823  -0.648  -0.755  1.00  0.00           N  
HETATM   17  S   UNL     1      -5.570  -1.384   0.527  1.00  0.00           S  
HETATM   18  O   UNL     1      -4.585  -2.267   1.046  1.00  0.00           O  
HETATM   19  C   UNL     1      -5.895  -0.036   1.696  1.00  0.00           C  
HETATM   20  O   UNL     1      -6.786  -1.880  -0.014  1.00  0.00           O  
HETATM   21  C   UNL     1      -3.637   1.339  -0.253  1.00  0.00           C  
HETATM   22  O   UNL     1      -4.714   1.893  -0.145  1.00  0.00           O  
HETATM   23  N   UNL     1      -2.520   2.060  -0.055  1.00  0.00           N  
HETATM   24  C   UNL     1      -1.268   1.471  -0.167  1.00  0.00           C  
HETATM   25  C   UNL     1      -0.104   2.198   0.034  1.00  0.00           C  
HETATM   26  C   UNL     1       1.122   1.577  -0.082  1.00  0.00           C  
HETATM   27  C   UNL     1       2.385   2.369   0.137  1.00  0.00           C  
HETATM   28  F   UNL     1       2.065   3.723   0.291  1.00  0.00           F  
HETATM   29  F   UNL     1       3.031   1.909   1.289  1.00  0.00           F  
HETATM   30  F   UNL     1       3.231   2.213  -0.966  1.00  0.00           F  
HETATM   31  H   UNL     1       6.548  -2.439  -0.979  1.00  0.00           H  
HETATM   32  H   UNL     1       7.775  -3.010   1.500  1.00  0.00           H  
HETATM   33  H   UNL     1       8.609  -3.006  -0.073  1.00  0.00           H  
HETATM   34  H   UNL     1       8.470  -1.499   0.865  1.00  0.00           H  
HETATM   35  H   UNL     1       2.390  -1.204  -2.541  1.00  0.00           H  
HETATM   36  H   UNL     1       3.376   0.001   1.417  1.00  0.00           H  
HETATM   37  H   UNL     1       0.114  -1.563  -0.861  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.223  -0.689  -1.638  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.537   0.707   1.223  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.391  -0.435   2.581  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.953   0.429   1.986  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.590   3.002   0.169  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.158   3.247   0.284  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    5    3    1    1                                       
CONECT    3    2    4   31                                            
CONECT    4    3   32   33   34                                       
CONECT    5    8    8    2    6                                       
CONECT    6    5    7    7                                            
CONECT    7    9    6    6   35                                       
CONECT    8    9    5    5   36                                       
CONECT    9   10    8    7                                            
CONECT   10   11   11   26    9                                       
CONECT   11   12   10   10   37                                       
CONECT   12   13   24   24   11                                       
CONECT   13   15   14   14   12                                       
CONECT   14   13   13                                                 
CONECT   15   16   21   13                                            
CONECT   16   17   15   38                                            
CONECT   17   20   20   16   18                                       
CONECT   17   18   19                                                 
CONECT   18   17   17                                                 
CONECT   19   17   39   40   41                                       
CONECT   20   17   17                                                 
CONECT   21   22   22   15   23                                       
CONECT   22   21   21                                                 
CONECT   23   21   24   42                                            
CONECT   24   23   12   12   25                                       
CONECT   25   24   26   26   43                                       
CONECT   26   25   25   10   27                                       
CONECT   27   26   30   28   29                                       
CONECT   28   27                                                      
CONECT   29   27                                                      
CONECT   30   27                                                      
CONECT   31    3                                                      
CONECT   32    4                                                      
CONECT   33    4                                                      
CONECT   34    4                                                      
CONECT   35    7                                                      
CONECT   36    8                                                      
CONECT   37   11                                                      
CONECT   38   16                                                      
CONECT   39   19                                                      
CONECT   40   19                                                      
CONECT   41   19                                                      
CONECT   42   23                                                      
CONECT   43   25                                                      
MASTER        0    0    0    0    0    0    0    0   43    0   43    0
END
