COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.591   2.391  -0.184  1.00  0.00           C  
HETATM    2  C   UNL     1       1.072   4.115  -0.270  1.00  0.00           C  
HETATM    3  C   UNL     1       3.600   5.007   0.058  1.00  0.00           C  
HETATM    4  C   UNL     1       1.807  -1.678  -0.442  1.00  0.00           C  
HETATM    5  C   UNL     1       2.877  -2.741  -0.182  1.00  0.00           C  
HETATM    6  C   UNL     1       4.159  -2.097   0.385  1.00  0.00           C  
HETATM    7  C   UNL     1       4.787  -3.839  -1.143  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.592   1.380  -0.795  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.857  -3.418   0.410  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.749  -1.534   0.606  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.057  -1.864   0.399  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.971  -0.911  -0.062  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.588   0.371  -0.297  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.315  -0.222   0.352  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.243   0.750  -0.106  1.00  0.00           C  
HETATM   16  C   UNL     1       1.716   1.919   0.464  1.00  0.00           C  
HETATM   17  C   UNL     1       0.394   1.481   0.282  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.215   3.723  -0.456  1.00  0.00           C  
HETATM   19  C   UNL     1       2.041   3.216   0.189  1.00  0.00           C  
HETATM   20  C   UNL     1       0.030   0.147   0.556  1.00  0.00           C  
HETATM   21  C   UNL     1       3.358  -3.372  -1.515  1.00  0.00           C  
HETATM   22  N   UNL     1      -1.853   1.999  -0.358  1.00  0.00           N  
HETATM   23  N   UNL     1       5.306  -2.784  -0.237  1.00  0.00           N  
HETATM   24  O   UNL     1       3.322   3.639   0.363  1.00  0.00           O  
HETATM   25  O   UNL     1      -3.477  -3.134   0.645  1.00  0.00           O  
HETATM   26  O   UNL     1      -5.867   0.751  -0.940  1.00  0.00           O  
HETATM   27  S   UNL     1       1.216  -1.019   1.137  1.00  0.00           S  
HETATM   28  H   UNL     1       1.352   5.136  -0.482  1.00  0.00           H  
HETATM   29  H   UNL     1       3.367   5.201  -0.990  1.00  0.00           H  
HETATM   30  H   UNL     1       2.990   5.652   0.690  1.00  0.00           H  
HETATM   31  H   UNL     1       4.655   5.213   0.239  1.00  0.00           H  
HETATM   32  H   UNL     1       2.234  -0.870  -1.036  1.00  0.00           H  
HETATM   33  H   UNL     1       0.974  -2.126  -0.984  1.00  0.00           H  
HETATM   34  H   UNL     1       2.500  -3.508   0.494  1.00  0.00           H  
HETATM   35  H   UNL     1       4.183  -1.036   0.136  1.00  0.00           H  
HETATM   36  H   UNL     1       4.191  -2.224   1.467  1.00  0.00           H  
HETATM   37  H   UNL     1       4.750  -4.798  -0.626  1.00  0.00           H  
HETATM   38  H   UNL     1       5.408  -3.911  -2.036  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.670   2.198  -0.079  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.268   1.770  -1.759  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.058  -4.464   0.644  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.473  -2.779   1.043  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.094  -3.228  -0.637  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.051  -2.277   0.962  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.002  -1.195  -0.219  1.00  0.00           H  
HETATM   46  H   UNL     1       2.472   1.234   0.818  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.950   4.430  -0.811  1.00  0.00           H  
HETATM   48  H   UNL     1       2.732  -4.219  -1.797  1.00  0.00           H  
HETATM   49  H   UNL     1       3.385  -2.627  -2.310  1.00  0.00           H  
HETATM   50  H   UNL     1       5.917  -3.178   0.463  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.563   1.342  -1.257  1.00  0.00           H  
CONECT    1   22   22   17   18                                       
CONECT    2   18   18   19   28                                       
CONECT    3   24   29   30   31                                       
CONECT    4    5   27   32   33                                       
CONECT    5   21    6    4   34                                       
CONECT    6   23    5   35   36                                       
CONECT    7   23   21   37   38                                       
CONECT    8   26   13   39   40                                       
CONECT    9   25   41   42   43                                       
CONECT   10   11   11   14   44                                       
CONECT   11   25   12   10   10                                       
CONECT   12   11   13   13   45                                       
CONECT   13   12   12    8   15                                       
CONECT   14   10   15   15   20                                       
CONECT   15   13   14   14   22                                       
CONECT   16   17   19   19   46                                       
CONECT   17   20   20    1   16                                       
CONECT   18    1    2    2   47                                       
CONECT   19   16   16    2   24                                       
CONECT   20   14   27   17   17                                       
CONECT   21    7    5   48   49                                       
CONECT   22   15    1    1                                            
CONECT   23    7    6   50                                            
CONECT   24   19    3                                                 
CONECT   25    9   11                                                 
CONECT   26    8   51                                                 
CONECT   27   20    4                                                 
CONECT   28    2                                                      
CONECT   29    3                                                      
CONECT   30    3                                                      
CONECT   31    3                                                      
CONECT   32    4                                                      
CONECT   33    4                                                      
CONECT   34    5                                                      
CONECT   35    6                                                      
CONECT   36    6                                                      
CONECT   37    7                                                      
CONECT   38    7                                                      
CONECT   39    8                                                      
CONECT   40    8                                                      
CONECT   41    9                                                      
CONECT   42    9                                                      
CONECT   43    9                                                      
CONECT   44   10                                                      
CONECT   45   12                                                      
CONECT   46   16                                                      
CONECT   47   18                                                      
CONECT   48   21                                                      
CONECT   49   21                                                      
CONECT   50   23                                                      
CONECT   51   26                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
