COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.647  -1.774   0.919  1.00  0.00           C  
HETATM    2  C   UNL     1       2.262   0.019   0.269  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.577  -1.881  -0.171  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.396   1.099   0.771  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.321  -2.724  -1.239  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.004   2.182   0.008  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.811  -2.736  -0.034  1.00  0.00           C  
HETATM    8  C   UNL     1       5.215   0.411  -1.149  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.502  -0.953   0.331  1.00  0.00           C  
HETATM   10  C   UNL     1       0.021  -0.103  -0.829  1.00  0.00           C  
HETATM   11  C   UNL     1       1.740  -0.831   1.429  1.00  0.00           C  
HETATM   12  C   UNL     1       1.113   0.840  -0.319  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.821  -1.887   0.431  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.735   0.770   0.868  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.311  -3.573  -1.704  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.554  -3.579  -1.102  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.950   2.939  -0.658  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.683   1.525   0.202  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.291   2.610  -0.561  1.00  0.00           C  
HETATM   20  F   UNL     1      -0.105  -2.718  -1.828  1.00  0.00           F  
HETATM   21  F   UNL     1      -5.027  -2.742   0.555  1.00  0.00           F  
HETATM   22  F   UNL     1       4.368  -0.538  -1.732  1.00  0.00           F  
HETATM   23  F   UNL     1       6.547   0.047  -1.373  1.00  0.00           F  
HETATM   24  F   UNL     1       4.971   1.665  -1.718  1.00  0.00           F  
HETATM   25  N   UNL     1       3.307   0.921   0.757  1.00  0.00           N  
HETATM   26  O   UNL     1      -0.217   1.077   2.040  1.00  0.00           O  
HETATM   27  O   UNL     1      -1.939  -0.624   2.555  1.00  0.00           O  
HETATM   28  O   UNL     1       4.952  -0.815   1.206  1.00  0.00           O  
HETATM   29  O   UNL     1       5.606   1.571   1.221  1.00  0.00           O  
HETATM   30  S   UNL     1      -1.188   0.131   1.613  1.00  0.00           S  
HETATM   31  S   UNL     1       4.900   0.485   0.636  1.00  0.00           S  
HETATM   32 CL   UNL     1      -5.480   3.560  -1.396  1.00  0.00          Cl  
HETATM   33  H   UNL     1       0.275  -2.380   1.746  1.00  0.00           H  
HETATM   34  H   UNL     1       1.060  -2.425   0.149  1.00  0.00           H  
HETATM   35  H   UNL     1       2.675  -0.633  -0.501  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.957   2.439  -0.068  1.00  0.00           H  
HETATM   37  H   UNL     1       0.434  -0.754  -1.599  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.798   0.482  -1.248  1.00  0.00           H  
HETATM   39  H   UNL     1       1.327  -0.180   2.200  1.00  0.00           H  
HETATM   40  H   UNL     1       2.558  -1.417   1.848  1.00  0.00           H  
HETATM   41  H   UNL     1       0.700   1.491   0.451  1.00  0.00           H  
HETATM   42  H   UNL     1       1.485   1.446  -1.145  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.021  -1.230   1.264  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.042  -0.077   1.464  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.111  -4.230  -2.538  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.327  -4.241  -1.465  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.643   3.786  -1.253  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.729   1.268   0.278  1.00  0.00           H  
HETATM   49  H   UNL     1       3.067   1.774   1.152  1.00  0.00           H  
CONECT    1   11    9   33   34                                       
CONECT    2   25   11   12   35                                       
CONECT    3    9    5    5   13                                       
CONECT    4   30   14   14    6                                       
CONECT    5   20    3    3   15                                       
CONECT    6    4   17   17   36                                       
CONECT    7   13   13   16   21                                       
CONECT    8   22   23   24   31                                       
CONECT    9   30    1   10    3                                       
CONECT   10   12    9   37   38                                       
CONECT   11    2    1   39   40                                       
CONECT   12    2   10   41   42                                       
CONECT   13    3    7    7   43                                       
CONECT   14    4    4   18   44                                       
CONECT   15    5   16   16   45                                       
CONECT   16   15   15    7   46                                       
CONECT   17    6    6   19   47                                       
CONECT   18   14   19   19   48                                       
CONECT   19   18   18   17   32                                       
CONECT   20    5                                                      
CONECT   21    7                                                      
CONECT   22    8                                                      
CONECT   23    8                                                      
CONECT   24    8                                                      
CONECT   25   31    2   49                                            
CONECT   26   30   30                                                 
CONECT   27   30   30                                                 
CONECT   28   31   31                                                 
CONECT   29   31   31                                                 
CONECT   30   27   27   26   26                                       
CONECT   30    4    9                                                 
CONECT   31    8   29   29   25                                       
CONECT   31   28   28                                                 
CONECT   32   19                                                      
CONECT   33    1                                                      
CONECT   34    1                                                      
CONECT   35    2                                                      
CONECT   36    6                                                      
CONECT   37   10                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   11                                                      
CONECT   41   12                                                      
CONECT   42   12                                                      
CONECT   43   13                                                      
CONECT   44   14                                                      
CONECT   45   15                                                      
CONECT   46   16                                                      
CONECT   47   17                                                      
CONECT   48   18                                                      
CONECT   49   25                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
