COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.963  -1.319  -0.150  1.00  0.00           C  
HETATM    2  C   UNL     1       5.427  -2.619  -0.142  1.00  0.00           C  
HETATM    3  C   UNL     1       4.544  -3.671   0.027  1.00  0.00           C  
HETATM    4  C   UNL     1       3.193  -3.426   0.190  1.00  0.00           C  
HETATM    5  C   UNL     1       2.717  -2.130   0.184  1.00  0.00           C  
HETATM    6  C   UNL     1       3.602  -1.067   0.014  1.00  0.00           C  
HETATM    7  C   UNL     1       3.098   0.328   0.012  1.00  0.00           C  
HETATM    8  C   UNL     1       1.741   0.577   0.181  1.00  0.00           C  
HETATM    9  C   UNL     1       3.986   1.391  -0.154  1.00  0.00           C  
HETATM   10  C   UNL     1       3.522   2.691  -0.155  1.00  0.00           C  
HETATM   11  C   UNL     1       2.172   2.949   0.007  1.00  0.00           C  
HETATM   12  F   UNL     1       1.723   4.223   0.004  1.00  0.00           F  
HETATM   13  C   UNL     1       1.273   1.891   0.179  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.168   2.165   0.357  1.00  0.00           C  
HETATM   15  O   UNL     1      -0.573   3.311   0.355  1.00  0.00           O  
HETATM   16  N   UNL     1      -1.032   1.144   0.523  1.00  0.00           N  
HETATM   17  N   UNL     1      -2.398   1.403   0.692  1.00  0.00           N  
HETATM   18  S   UNL     1      -3.507   0.692  -0.312  1.00  0.00           S  
HETATM   19  O   UNL     1      -4.788   1.027   0.204  1.00  0.00           O  
HETATM   20  O   UNL     1      -3.100   0.997  -1.639  1.00  0.00           O  
HETATM   21  C   UNL     1      -3.335  -1.051  -0.127  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.455  -1.749  -0.933  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.321  -3.117  -0.788  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.066  -3.787   0.164  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.945  -3.090   0.971  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.077  -1.721   0.829  1.00  0.00           C  
HETATM   27  H   UNL     1       5.653  -0.499  -0.278  1.00  0.00           H  
HETATM   28  H   UNL     1       6.482  -2.816  -0.269  1.00  0.00           H  
HETATM   29  H   UNL     1       4.912  -4.686   0.033  1.00  0.00           H  
HETATM   30  H   UNL     1       2.508  -4.251   0.321  1.00  0.00           H  
HETATM   31  H   UNL     1       1.662  -1.941   0.310  1.00  0.00           H  
HETATM   32  H   UNL     1       1.051  -0.243   0.313  1.00  0.00           H  
HETATM   33  H   UNL     1       5.041   1.196  -0.281  1.00  0.00           H  
HETATM   34  H   UNL     1       4.215   3.509  -0.283  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.708   0.230   0.524  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.695   2.000   1.397  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.873  -1.225  -1.677  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.634  -3.662  -1.418  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.961  -4.856   0.278  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.528  -3.614   1.714  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.761  -1.176   1.462  1.00  0.00           H  
CONECT    1    2    6    6   27                                       
CONECT    2    3    3    1   28                                       
CONECT    3    2    2    4   29                                       
CONECT    4    3    5    5   30                                       
CONECT    5    4    4    6   31                                       
CONECT    6    1    1    5    7                                       
CONECT    7    6    8    8    9                                       
CONECT    8    7    7   13   32                                       
CONECT    9    7   10   10   33                                       
CONECT   10    9    9   11   34                                       
CONECT   11   13   13   10   12                                       
CONECT   12   11                                                      
CONECT   13    8   14   11   11                                       
CONECT   14   15   15   13   16                                       
CONECT   15   14   14                                                 
CONECT   16   14   17   35                                            
CONECT   17   16   18   36                                            
CONECT   18   17   20   20   19                                       
CONECT   18   19   21                                                 
CONECT   19   18   18                                                 
CONECT   20   18   18                                                 
CONECT   21   18   26   26   22                                       
CONECT   22   21   23   23   37                                       
CONECT   23   22   22   24   38                                       
CONECT   24   25   25   23   39                                       
CONECT   25   26   24   24   40                                       
CONECT   26   21   21   25   41                                       
CONECT   27    1                                                      
CONECT   28    2                                                      
CONECT   29    3                                                      
CONECT   30    4                                                      
CONECT   31    5                                                      
CONECT   32    8                                                      
CONECT   33    9                                                      
CONECT   34   10                                                      
CONECT   35   16                                                      
CONECT   36   17                                                      
CONECT   37   22                                                      
CONECT   38   23                                                      
CONECT   39   24                                                      
CONECT   40   25                                                      
CONECT   41   26                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
