COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       3.266  -2.171  -0.728  1.00  0.00           O  
HETATM    2  C   UNL     1       3.190  -1.003  -0.383  1.00  0.00           C  
HETATM    3  N   UNL     1       4.196  -0.174  -0.652  1.00  0.00           N  
HETATM    4  C   UNL     1       4.141   1.101  -0.289  1.00  0.00           C  
HETATM    5  N   UNL     1       5.187   1.948  -0.574  1.00  0.00           N  
HETATM    6  C   UNL     1       3.001   1.584   0.390  1.00  0.00           C  
HETATM    7  F   UNL     1       2.925   2.879   0.768  1.00  0.00           F  
HETATM    8  C   UNL     1       1.985   0.728   0.657  1.00  0.00           C  
HETATM    9  N   UNL     1       2.087  -0.573   0.258  1.00  0.00           N  
HETATM   10  C   UNL     1       0.994  -1.508   0.534  1.00  0.00           C  
HETATM   11  O   UNL     1      -0.080  -0.821   1.191  1.00  0.00           O  
HETATM   12  C   UNL     1       0.439  -2.080  -0.802  1.00  0.00           C  
HETATM   13  S   UNL     1      -1.210  -2.672  -0.241  1.00  0.00           S  
HETATM   14  C   UNL     1      -1.278  -1.617   1.258  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.518  -0.721   1.225  1.00  0.00           C  
HETATM   16  O   UNL     1      -2.529   0.033   0.011  1.00  0.00           O  
HETATM   17  P   UNL     1      -3.693   1.082  -0.359  1.00  0.00           P  
HETATM   18  O   UNL     1      -3.452   1.646  -1.848  1.00  0.00           O  
HETATM   19  O   UNL     1      -5.007   0.405  -0.294  1.00  0.00           O  
HETATM   20  H   UNL     1       5.969   1.614  -1.041  1.00  0.00           H  
HETATM   21  H   UNL     1       5.144   2.880  -0.307  1.00  0.00           H  
HETATM   22  H   UNL     1       1.103   1.072   1.176  1.00  0.00           H  
HETATM   23  H   UNL     1       1.353  -2.321   1.165  1.00  0.00           H  
HETATM   24  H   UNL     1       0.343  -1.300  -1.557  1.00  0.00           H  
HETATM   25  H   UNL     1       1.053  -2.905  -1.164  1.00  0.00           H  
HETATM   26  H   UNL     1      -1.276  -2.233   2.158  1.00  0.00           H  
HETATM   27  H   UNL     1      -3.415  -1.339   1.277  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.497  -0.040   2.076  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.117   2.286  -2.138  1.00  0.00           H  
HETATM   30  O   UNL     1      -3.666   2.304   0.689  1.00  0.00           O  
HETATM   31  H   UNL     1      -2.833   2.795   0.701  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    9                                       
CONECT    3    2    4    4                                            
CONECT    4    3    3    5    6                                       
CONECT    5    4   20   21                                            
CONECT    6    4    8    8    7                                       
CONECT    7    6                                                      
CONECT    8    9    6    6   22                                       
CONECT    9    2   10    8                                            
CONECT   10    9   11   12   23                                       
CONECT   11   10   14                                                 
CONECT   12   10   13   24   25                                       
CONECT   13   12   14                                                 
CONECT   14   11   13   15   26                                       
CONECT   15   14   16   27   28                                       
CONECT   16   15   17                                                 
CONECT   17   16   18   19   19                                       
CONECT   17   30                                                      
CONECT   18   17   29                                                 
CONECT   19   17   17                                                 
CONECT   20    5                                                      
CONECT   21    5                                                      
CONECT   22    8                                                      
CONECT   23   10                                                      
CONECT   24   12                                                      
CONECT   25   12                                                      
CONECT   26   14                                                      
CONECT   27   15                                                      
CONECT   28   15                                                      
CONECT   29   18                                                      
CONECT   30   17   31                                                 
CONECT   31   30                                                      
MASTER        0    0    0    0    0    0    0    0   31    0   31    0
END
