COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.830  -4.254   1.271  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.614   0.798   1.031  1.00  0.00           C  
HETATM    3  C   UNL     1       2.302  -4.204  -1.069  1.00  0.00           C  
HETATM    4  C   UNL     1       1.005   2.502   1.889  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.257   0.568   0.825  1.00  0.00           C  
HETATM    6  C   UNL     1       1.498   2.176  -0.298  1.00  0.00           C  
HETATM    7  C   UNL     1       1.937  -2.258   0.288  1.00  0.00           C  
HETATM    8  C   UNL     1       1.883  -2.891  -0.947  1.00  0.00           C  
HETATM    9  C   UNL     1       1.649   1.775  -1.691  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.422   1.413  -2.266  1.00  0.00           C  
HETATM   11  C   UNL     1       2.487   4.460   2.382  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.436   1.289  -1.102  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.042  -1.559   0.813  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.695  -1.792   0.608  1.00  0.00           C  
HETATM   15  C   UNL     1       2.412  -2.943   1.396  1.00  0.00           C  
HETATM   16  C   UNL     1       0.700   1.701   0.831  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.504  -0.266   1.025  1.00  0.00           C  
HETATM   18  C   UNL     1       0.202  -0.736   0.613  1.00  0.00           C  
HETATM   19  C   UNL     1       2.775  -4.885   0.040  1.00  0.00           C  
HETATM   20  C   UNL     1       2.245   3.259   0.180  1.00  0.00           C  
HETATM   21  C   UNL     1       2.504   2.461  -2.476  1.00  0.00           C  
HETATM   22  C   UNL     1       3.116   3.920  -0.707  1.00  0.00           C  
HETATM   23  N   UNL     1       1.923   3.429   1.507  1.00  0.00           N  
HETATM   24  N   UNL     1       3.222   3.513  -1.985  1.00  0.00           N  
HETATM   25  N   UNL     1      -3.869  -0.036   1.233  1.00  0.00           N  
HETATM   26  O   UNL     1       3.778   4.867  -0.315  1.00  0.00           O  
HETATM   27  O   UNL     1      -6.195   0.139   0.541  1.00  0.00           O  
HETATM   28  O   UNL     1      -4.629  -1.338  -0.678  1.00  0.00           O  
HETATM   29  O   UNL     1       1.526  -0.968   0.410  1.00  0.00           O  
HETATM   30  F   UNL     1       3.184  -6.167  -0.080  1.00  0.00           F  
HETATM   31  F   UNL     1       1.421  -2.226  -2.029  1.00  0.00           F  
HETATM   32  S   UNL     1      -4.922  -0.101  -0.043  1.00  0.00           S  
HETATM   33  H   UNL     1       3.203  -4.786   2.133  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.973   1.803   1.200  1.00  0.00           H  
HETATM   35  H   UNL     1       2.259  -4.698  -2.029  1.00  0.00           H  
HETATM   36  H   UNL     1       0.580   2.417   2.878  1.00  0.00           H  
HETATM   37  H   UNL     1       1.086   0.943  -2.088  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.129   2.249  -2.902  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.413   0.492  -2.849  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.424   1.587  -1.876  1.00  0.00           H  
HETATM   41  H   UNL     1       3.385   4.075   2.865  1.00  0.00           H  
HETATM   42  H   UNL     1       2.742   5.339   1.789  1.00  0.00           H  
HETATM   43  H   UNL     1       1.754   4.734   3.141  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.433   1.115  -1.492  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.444   2.211  -0.520  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.738  -2.385   0.808  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.341  -2.799   0.444  1.00  0.00           H  
HETATM   48  H   UNL     1       2.455  -2.452   2.357  1.00  0.00           H  
HETATM   49  H   UNL     1       2.624   2.172  -3.510  1.00  0.00           H  
HETATM   50  H   UNL     1       3.829   3.983  -2.578  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.198   0.160   2.124  1.00  0.00           H  
CONECT    1   15   15   19   33                                       
CONECT    2    5    5   17   34                                       
CONECT    3    8   19   19   35                                       
CONECT    4   16   16   23   36                                       
CONECT    5    2    2   16   18                                       
CONECT    6    9   16   20   20                                       
CONECT    7    8    8   15   29                                       
CONECT    8    3    7    7   31                                       
CONECT    9    6   21   21   37                                       
CONECT   10   12   38   39   40                                       
CONECT   11   23   41   42   43                                       
CONECT   12   10   32   44   45                                       
CONECT   13   14   17   17   46                                       
CONECT   14   13   18   18   47                                       
CONECT   15    1    1    7   48                                       
CONECT   16    4    4    5    6                                       
CONECT   17    2   13   13   25                                       
CONECT   18    5   14   14   29                                       
CONECT   19    1    3    3   30                                       
CONECT   20    6    6   22   23                                       
CONECT   21    9    9   24   49                                       
CONECT   22   20   24   26   26                                       
CONECT   23    4   11   20                                            
CONECT   24   21   22   50                                            
CONECT   25   17   32   51                                            
CONECT   26   22   22                                                 
CONECT   27   32   32                                                 
CONECT   28   32   32                                                 
CONECT   29    7   18                                                 
CONECT   30   19                                                      
CONECT   31    8                                                      
CONECT   32   12   25   27   27                                       
CONECT   32   28   28                                                 
CONECT   33    1                                                      
CONECT   34    2                                                      
CONECT   35    3                                                      
CONECT   36    4                                                      
CONECT   37    9                                                      
CONECT   38   10                                                      
CONECT   39   10                                                      
CONECT   40   10                                                      
CONECT   41   11                                                      
CONECT   42   11                                                      
CONECT   43   11                                                      
CONECT   44   12                                                      
CONECT   45   12                                                      
CONECT   46   13                                                      
CONECT   47   14                                                      
CONECT   48   15                                                      
CONECT   49   21                                                      
CONECT   50   24                                                      
CONECT   51   25                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
