COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      34.534   7.833 115.496  1.00  0.00           C  
HETATM    2  C   UNL     1      34.155   8.959 114.766  1.00  0.00           C  
HETATM    3  C   UNL     1      35.075   9.668 114.017  1.00  0.00           C  
HETATM    4  C   UNL     1      36.372   9.236 114.006  1.00  0.00           C  
HETATM    5  C   UNL     1      37.411   5.664 115.829  1.00  0.00           C  
HETATM    6  C   UNL     1      37.166   4.797 114.626  1.00  0.00           C  
HETATM    7  C   UNL     1      32.763   5.014 116.902  1.00  0.00           C  
HETATM    8  C   UNL     1      31.677   4.579 115.951  1.00  0.00           C  
HETATM    9  C   UNL     1      31.719   4.895 114.597  1.00  0.00           C  
HETATM   10  C   UNL     1      30.709   4.485 113.740  1.00  0.00           C  
HETATM   11  C   UNL     1      30.600   3.846 116.425  1.00  0.00           C  
HETATM   12  N   UNL     1      33.367   5.821 116.154  1.00  0.00           N  
HETATM   13  C   UNL     1      33.466   7.145 116.288  1.00  0.00           C  
HETATM   14  O   UNL     1      32.728   7.785 117.032  1.00  0.00           O  
HETATM   15  C   UNL     1      29.633   3.761 114.223  1.00  0.00           C  
HETATM   16  C   UNL     1      29.592   3.450 115.568  1.00  0.00           C  
HETATM   17  C   UNL     1      28.912   1.811 117.680  1.00  0.00           C  
HETATM   18  C   UNL     1      36.809   8.134 114.698  1.00  0.00           C  
HETATM   19  C   UNL     1      35.874   7.440 115.443  1.00  0.00           C  
HETATM   20  F   UNL     1      37.282   9.934 113.273  1.00  0.00           F  
HETATM   21  O   UNL     1      36.202   6.327 116.172  1.00  0.00           O  
HETATM   22  O   UNL     1      35.923   4.831 114.221  1.00  0.00           O  
HETATM   23  O   UNL     1      38.033   4.159 114.079  1.00  0.00           O  
HETATM   24  O   UNL     1      28.150   1.339 115.249  1.00  0.00           O  
HETATM   25  S   UNL     1      28.233   2.484 116.210  1.00  0.00           S1-
HETATM   26  H   UNL     1      33.125   9.283 114.786  1.00  0.00           H  
HETATM   27  H   UNL     1      34.777  10.541 113.455  1.00  0.00           H  
HETATM   28  H   UNL     1      37.742   5.040 116.672  1.00  0.00           H  
HETATM   29  H   UNL     1      38.187   6.408 115.596  1.00  0.00           H  
HETATM   30  H   UNL     1      32.355   5.507 117.797  1.00  0.00           H  
HETATM   31  H   UNL     1      33.405   4.174 117.207  1.00  0.00           H  
HETATM   32  H   UNL     1      32.549   5.467 114.208  1.00  0.00           H  
HETATM   33  H   UNL     1      30.762   4.732 112.690  1.00  0.00           H  
HETATM   34  H   UNL     1      30.549   3.583 117.471  1.00  0.00           H  
HETATM   35  H   UNL     1      33.830   5.424 115.362  1.00  0.00           H  
HETATM   36  H   UNL     1      28.840   3.445 113.561  1.00  0.00           H  
HETATM   37  H   UNL     1      29.003   2.603 118.438  1.00  0.00           H  
HETATM   38  H   UNL     1      28.253   1.016 118.058  1.00  0.00           H  
HETATM   39  H   UNL     1      29.906   1.392 117.466  1.00  0.00           H  
HETATM   40  H   UNL     1      37.842   7.822 114.662  1.00  0.00           H  
HETATM   41  H   UNL     1      35.826   4.286 113.449  1.00  0.00           H  
HETATM   42  H   UNL     1      27.445   0.758 115.508  1.00  0.00           H  
CONECT    1    2    2   19   13                                       
CONECT    2    3    1    1   26                                       
CONECT    3    4    4    2   27                                       
CONECT    4   20    3    3   18                                       
CONECT    5    6   21   28   29                                       
CONECT    6   23   23   22    5                                       
CONECT    7    8   12   30   31                                       
CONECT    8    9    9   11    7                                       
CONECT    9   10    8    8   32                                       
CONECT   10   15   15    9   33                                       
CONECT   11   16   16    8   34                                       
CONECT   12   13    7   35                                            
CONECT   13    1   12   14   14                                       
CONECT   14   13   13                                                 
CONECT   15   10   10   16   36                                       
CONECT   16   15   25   11   11                                       
CONECT   17   25   37   38   39                                       
CONECT   18    4   19   19   40                                       
CONECT   19   18   18    1   21                                       
CONECT   20    4                                                      
CONECT   21   19    5                                                 
CONECT   22    6   41                                                 
CONECT   23    6    6                                                 
CONECT   24   25   42                                                 
CONECT   25   24   16   17                                            
CONECT   26    2                                                      
CONECT   27    3                                                      
CONECT   28    5                                                      
CONECT   29    5                                                      
CONECT   30    7                                                      
CONECT   31    7                                                      
CONECT   32    9                                                      
CONECT   33   10                                                      
CONECT   34   11                                                      
CONECT   35   12                                                      
CONECT   36   15                                                      
CONECT   37   17                                                      
CONECT   38   17                                                      
CONECT   39   17                                                      
CONECT   40   18                                                      
CONECT   41   22                                                      
CONECT   42   24                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
