COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.223   0.193  -0.132  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.412  -0.273   0.460  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.561  -0.370   0.497  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.892  -0.461  -0.060  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.738  -1.778  -0.486  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.500  -2.390  -0.422  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.410  -1.686   0.068  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.794   0.241   0.434  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.956   1.666   0.899  1.00  0.00           C  
HETATM   10  N   UNL     1      -5.831   1.598  -0.614  1.00  0.00           N  
HETATM   11  C   UNL     1      -4.516   1.352  -0.789  1.00  0.00           C  
HETATM   12  C   UNL     1      -6.570   2.743  -1.151  1.00  0.00           C  
HETATM   13  C   UNL     1       0.967  -3.736  -0.029  1.00  0.00           C  
HETATM   14  C   UNL     1       0.086  -4.142  -1.218  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.371  -3.817  -0.886  1.00  0.00           C  
HETATM   16  C   UNL     1       1.997  -1.501   0.354  1.00  0.00           C  
HETATM   17  C   UNL     1       2.789  -1.740   1.471  1.00  0.00           C  
HETATM   18  C   UNL     1       3.917  -0.971   1.679  1.00  0.00           C  
HETATM   19  C   UNL     1       4.249   0.027   0.780  1.00  0.00           C  
HETATM   20  C   UNL     1       3.469   0.286  -0.348  1.00  0.00           C  
HETATM   21  C   UNL     1       2.327  -0.505  -0.544  1.00  0.00           C  
HETATM   22  C   UNL     1       5.056   1.950  -0.780  1.00  0.00           C  
HETATM   23  C   UNL     1       3.223   1.701  -2.364  1.00  0.00           C  
HETATM   24  F   UNL     1      -3.161   1.794   1.598  1.00  0.00           F  
HETATM   25  F   UNL     1      -0.891   2.006   1.739  1.00  0.00           F  
HETATM   26  N   UNL     1       0.856  -2.280   0.135  1.00  0.00           N  
HETATM   27  N   UNL     1       3.938   1.315  -1.145  1.00  0.00           N  
HETATM   28  N   UNL     1      -6.368   0.569   0.169  1.00  0.00           N  
HETATM   29  O   UNL     1       5.599   2.869  -1.364  1.00  0.00           O  
HETATM   30  S   UNL     1       5.588   1.182   0.725  1.00  0.00           S  
HETATM   31  H   UNL     1      -5.517  -1.171   1.052  1.00  0.00           H  
HETATM   32  H   UNL     1       0.289   0.171   0.884  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.589  -2.322  -0.868  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.964   2.331   0.035  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.822   1.962  -1.347  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.966   2.492  -2.135  1.00  0.00           H  
HETATM   37  H   UNL     1      -7.392   2.992  -0.481  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.900   3.599  -1.237  1.00  0.00           H  
HETATM   39  H   UNL     1       0.621  -4.237   0.875  1.00  0.00           H  
HETATM   40  H   UNL     1       2.003  -4.008  -0.228  1.00  0.00           H  
HETATM   41  H   UNL     1       0.391  -3.588  -2.105  1.00  0.00           H  
HETATM   42  H   UNL     1       0.189  -5.212  -1.400  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.718  -4.485  -0.098  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.983  -3.963  -1.776  1.00  0.00           H  
HETATM   45  H   UNL     1       2.526  -2.520   2.170  1.00  0.00           H  
HETATM   46  H   UNL     1       4.540  -1.148   2.543  1.00  0.00           H  
HETATM   47  H   UNL     1       1.702  -0.336  -1.408  1.00  0.00           H  
HETATM   48  H   UNL     1       2.488   2.469  -2.126  1.00  0.00           H  
HETATM   49  H   UNL     1       3.934   2.091  -3.093  1.00  0.00           H  
HETATM   50  H   UNL     1       2.718   0.830  -2.780  1.00  0.00           H  
CONECT    1    4    2   11   11                                       
CONECT    2    1   28   28   31                                       
CONECT    3    8    8    7   32                                       
CONECT    4    8    1    5    5                                       
CONECT    5    4    4    6   33                                       
CONECT    6    7    7    5   15                                       
CONECT    7    3   26    6    6                                       
CONECT    8    9    3    3    4                                       
CONECT    9   24   25    8   34                                       
CONECT   10   28   11   12                                            
CONECT   11    1    1   10   35                                       
CONECT   12   10   36   37   38                                       
CONECT   13   26   14   39   40                                       
CONECT   14   13   15   41   42                                       
CONECT   15    6   14   43   44                                       
CONECT   16   17   17   21   26                                       
CONECT   17   18   16   16   45                                       
CONECT   18   19   19   17   46                                       
CONECT   19   30   18   18   20                                       
CONECT   20   19   27   21   21                                       
CONECT   21   20   20   16   47                                       
CONECT   22   30   29   29   27                                       
CONECT   23   27   48   49   50                                       
CONECT   24    9                                                      
CONECT   25    9                                                      
CONECT   26   16    7   13                                            
CONECT   27   22   20   23                                            
CONECT   28    2    2   10                                            
CONECT   29   22   22                                                 
CONECT   30   19   22                                                 
CONECT   31    2                                                      
CONECT   32    3                                                      
CONECT   33    5                                                      
CONECT   34    9                                                      
CONECT   35   11                                                      
CONECT   36   12                                                      
CONECT   37   12                                                      
CONECT   38   12                                                      
CONECT   39   13                                                      
CONECT   40   13                                                      
CONECT   41   14                                                      
CONECT   42   14                                                      
CONECT   43   15                                                      
CONECT   44   15                                                      
CONECT   45   17                                                      
CONECT   46   18                                                      
CONECT   47   21                                                      
CONECT   48   23                                                      
CONECT   49   23                                                      
CONECT   50   23                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
