COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.933  -0.343   0.274  1.00  0.00           C  
HETATM    2  C   UNL     1       3.503  -0.986   0.422  1.00  0.00           C  
HETATM    3  C   UNL     1       4.301   0.170   0.434  1.00  0.00           C  
HETATM    4  C   UNL     1       3.994   1.235  -0.449  1.00  0.00           C  
HETATM    5  C   UNL     1       5.846   2.474   0.420  1.00  0.00           C  
HETATM    6  C   UNL     1       5.398   0.291   1.304  1.00  0.00           C  
HETATM    7  C   UNL     1       2.144  -0.019  -1.299  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.140   4.955  -0.207  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.467   3.467  -0.063  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.346   2.011   0.000  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.712   1.763  -0.043  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.190   0.472   0.077  1.00  0.00           C  
HETATM   13  C   UNL     1      -6.674   0.213   0.035  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.310  -0.583   0.235  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.455   0.964   0.157  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.988  -1.465   0.443  1.00  0.00           C  
HETATM   17  C   UNL     1       2.448  -1.068  -0.434  1.00  0.00           C  
HETATM   18  C   UNL     1       4.792   2.392  -0.437  1.00  0.00           C  
HETATM   19  C   UNL     1       6.149   1.426   1.287  1.00  0.00           C  
HETATM   20  C   UNL     1       2.898   1.114  -1.319  1.00  0.00           C  
HETATM   21  F   UNL     1      -4.780  -1.845   0.352  1.00  0.00           F  
HETATM   22  N   UNL     1      -0.662  -1.230   0.485  1.00  0.00           N  
HETATM   23  N   UNL     1       0.234  -2.295   0.646  1.00  0.00           N  
HETATM   24  O   UNL     1      -2.884   3.284  -0.115  1.00  0.00           O  
HETATM   25  O   UNL     1      -2.407  -2.602   0.544  1.00  0.00           O  
HETATM   26  O   UNL     1       0.839  -2.574  -1.730  1.00  0.00           O  
HETATM   27  O   UNL     1       2.266  -3.569   0.065  1.00  0.00           O  
HETATM   28  S   UNL     1       1.454  -2.523  -0.450  1.00  0.00           S  
HETATM   29  H   UNL     1       3.727  -1.808   1.087  1.00  0.00           H  
HETATM   30  H   UNL     1       6.458   3.364   0.427  1.00  0.00           H  
HETATM   31  H   UNL     1       5.644  -0.512   1.983  1.00  0.00           H  
HETATM   32  H   UNL     1       1.302  -0.109  -1.969  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.060   5.094  -0.168  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.519   5.319  -1.162  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.608   5.510   0.606  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.999   2.911  -0.876  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.089   3.102   0.892  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.404   2.583  -0.166  1.00  0.00           H  
HETATM   39  H   UNL     1      -7.080   0.263   1.046  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.156   0.965  -0.588  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.858  -0.777  -0.382  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.393   1.157   0.191  1.00  0.00           H  
HETATM   43  H   UNL     1       4.570   3.212  -1.104  1.00  0.00           H  
HETATM   44  H   UNL     1       6.992   1.516   1.957  1.00  0.00           H  
HETATM   45  H   UNL     1       2.651   1.918  -1.998  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.328  -0.323   0.405  1.00  0.00           H  
HETATM   47  H   UNL     1       0.140  -2.898   1.399  1.00  0.00           H  
CONECT    1   14   16   15   15                                       
CONECT    2    3   17   17   29                                       
CONECT    3    4    4    6    2                                       
CONECT    4   18   20    3    3                                       
CONECT    5   18   18   19   30                                       
CONECT    6   19   19    3   31                                       
CONECT    7   20   20   17   32                                       
CONECT    8    9   33   34   35                                       
CONECT    9   24    8   36   37                                       
CONECT   10   11   11   15   24                                       
CONECT   11   12   10   10   38                                       
CONECT   12   13   14   14   11                                       
CONECT   13   12   39   40   41                                       
CONECT   14   21   12   12    1                                       
CONECT   15    1    1   10   42                                       
CONECT   16   22    1   25   25                                       
CONECT   17    7    2    2   28                                       
CONECT   18    5    5    4   43                                       
CONECT   19    5    6    6   44                                       
CONECT   20    4    7    7   45                                       
CONECT   21   14                                                      
CONECT   22   23   16   46                                            
CONECT   23   28   22   47                                            
CONECT   24   10    9                                                 
CONECT   25   16   16                                                 
CONECT   26   28   28                                                 
CONECT   27   28   28                                                 
CONECT   28   17   27   27   26                                       
CONECT   28   26   23                                                 
CONECT   29    2                                                      
CONECT   30    5                                                      
CONECT   31    6                                                      
CONECT   32    7                                                      
CONECT   33    8                                                      
CONECT   34    8                                                      
CONECT   35    8                                                      
CONECT   36    9                                                      
CONECT   37    9                                                      
CONECT   38   11                                                      
CONECT   39   13                                                      
CONECT   40   13                                                      
CONECT   41   13                                                      
CONECT   42   15                                                      
CONECT   43   18                                                      
CONECT   44   19                                                      
CONECT   45   20                                                      
CONECT   46   22                                                      
CONECT   47   23                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
