COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.939   0.229   0.628  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.307  -0.002   1.367  1.00  0.00           C  
HETATM    3  C   UNL     1      -7.102   0.137  -0.211  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.197   0.338  -1.238  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.843   0.361  -0.973  1.00  0.00           C  
HETATM    6  C   UNL     1       3.898   0.406   0.222  1.00  0.00           C  
HETATM    7  C   UNL     1       6.127  -0.396  -0.144  1.00  0.00           C  
HETATM    8  C   UNL     1       7.887   1.204  -0.127  1.00  0.00           C  
HETATM    9  C   UNL     1       6.598  -2.828  -0.530  1.00  0.00           C  
HETATM   10  C   UNL     1       5.645  -1.691  -0.266  1.00  0.00           C  
HETATM   11  C   UNL     1       4.292  -1.939  -0.144  1.00  0.00           C  
HETATM   12  C   UNL     1       3.414  -0.891   0.101  1.00  0.00           C  
HETATM   13  C   UNL     1       0.997   0.445   0.562  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.498   0.343   0.721  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.389   0.195   0.336  1.00  0.00           C  
HETATM   16  C   UNL     1      -6.658  -0.033   1.088  1.00  0.00           C  
HETATM   17  C   UNL     1      -8.579   0.103  -0.509  1.00  0.00           C  
HETATM   18  C   UNL     1       5.251   0.651   0.100  1.00  0.00           C  
HETATM   19  C   UNL     1       9.383   1.278  -0.289  1.00  0.00           C  
HETATM   20  F   UNL     1      -9.290   0.566   0.603  1.00  0.00           F  
HETATM   21  F   UNL     1      -8.852   0.921  -1.611  1.00  0.00           F  
HETATM   22  F   UNL     1      -8.967  -1.210  -0.796  1.00  0.00           F  
HETATM   23  N   UNL     1      -1.125   0.150   1.836  1.00  0.00           N  
HETATM   24  N   UNL     1      -2.385   0.089   1.802  1.00  0.00           N  
HETATM   25  O   UNL     1       7.460  -0.153  -0.264  1.00  0.00           O  
HETATM   26  O   UNL     1      10.019   0.272  -0.500  1.00  0.00           O  
HETATM   27  O   UNL     1      10.010   2.462  -0.199  1.00  0.00           O  
HETATM   28  S   UNL     1       1.687  -1.205   0.257  1.00  0.00           S  
HETATM   29  S   UNL     1      -1.644   0.460  -0.547  1.00  0.00           S  
HETATM   30  H   UNL     1      -4.961  -0.135   2.382  1.00  0.00           H  
HETATM   31  H   UNL     1      -6.551   0.470  -2.250  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.137   0.517  -1.776  1.00  0.00           H  
HETATM   33  H   UNL     1       3.215   1.222   0.408  1.00  0.00           H  
HETATM   34  H   UNL     1       7.609   1.574   0.860  1.00  0.00           H  
HETATM   35  H   UNL     1       7.408   1.814  -0.892  1.00  0.00           H  
HETATM   36  H   UNL     1       6.944  -3.240   0.418  1.00  0.00           H  
HETATM   37  H   UNL     1       6.088  -3.605  -1.100  1.00  0.00           H  
HETATM   38  H   UNL     1       7.452  -2.461  -1.100  1.00  0.00           H  
HETATM   39  H   UNL     1       3.917  -2.947  -0.239  1.00  0.00           H  
HETATM   40  H   UNL     1       1.230   1.097  -0.279  1.00  0.00           H  
HETATM   41  H   UNL     1       1.432   0.857   1.473  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.369  -0.189   1.885  1.00  0.00           H  
HETATM   43  H   UNL     1       5.628   1.659   0.195  1.00  0.00           H  
HETATM   44  H   UNL     1      10.971   2.459  -0.310  1.00  0.00           H  
CONECT    1   29   24   24   15                                       
CONECT    2   15   15   16   30                                       
CONECT    3   16   16    4   17                                       
CONECT    4    5    5    3   31                                       
CONECT    5   15    4    4   32                                       
CONECT    6   18   12   12   33                                       
CONECT    7   18   18   25   10                                       
CONECT    8   19   25   34   35                                       
CONECT    9   10   36   37   38                                       
CONECT   10    7   11   11    9                                       
CONECT   11   12   10   10   39                                       
CONECT   12    6    6   28   11                                       
CONECT   13   28   14   40   41                                       
CONECT   14   13   23   23   29                                       
CONECT   15    1    2    2    5                                       
CONECT   16    2    3    3   42                                       
CONECT   17    3   22   21   20                                       
CONECT   18    6    7    7   43                                       
CONECT   19   26   26   27    8                                       
CONECT   20   17                                                      
CONECT   21   17                                                      
CONECT   22   17                                                      
CONECT   23   14   14   24                                            
CONECT   24   23    1    1                                            
CONECT   25    8    7                                                 
CONECT   26   19   19                                                 
CONECT   27   19   44                                                 
CONECT   28   12   13                                                 
CONECT   29   14    1                                                 
CONECT   30    2                                                      
CONECT   31    4                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    8                                                      
CONECT   35    8                                                      
CONECT   36    9                                                      
CONECT   37    9                                                      
CONECT   38    9                                                      
CONECT   39   11                                                      
CONECT   40   13                                                      
CONECT   41   13                                                      
CONECT   42   16                                                      
CONECT   43   18                                                      
CONECT   44   27                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
