COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.684   2.168   0.413  1.00  0.00           C  
HETATM    2  C   UNL     1       0.552   2.158  -0.682  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.221   0.094   0.463  1.00  0.00           C  
HETATM    4  C   UNL     1       3.912  -2.932   1.978  1.00  0.00           C  
HETATM    5  C   UNL     1       0.639   0.777  -0.840  1.00  0.00           C  
HETATM    6  C   UNL     1       1.766   0.095  -0.369  1.00  0.00           C  
HETATM    7  C   UNL     1       2.839  -2.286   1.391  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.727  -0.927  -1.486  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.303  -0.426  -2.779  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.371  -0.310   1.721  1.00  0.00           C  
HETATM   11  C   UNL     1      -7.815  -1.443   2.545  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.087  -1.584  -4.773  1.00  0.00           C  
HETATM   13  C   UNL     1      -6.485  -0.752   2.849  1.00  0.00           C  
HETATM   14  C   UNL     1       4.063  -2.136  -0.672  1.00  0.00           C  
HETATM   15  C   UNL     1       2.781   0.797   0.262  1.00  0.00           C  
HETATM   16  C   UNL     1       5.135  -2.777  -0.080  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.723  -0.220  -0.812  1.00  0.00           C  
HETATM   18  C   UNL     1       2.913  -1.887   0.062  1.00  0.00           C  
HETATM   19  C   UNL     1       5.061  -3.175   1.243  1.00  0.00           C  
HETATM   20  C   UNL     1       1.573   2.846  -0.058  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.485  -0.410   0.548  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.455   0.034  -1.509  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.480  -1.367  -2.807  1.00  0.00           C  
HETATM   24  C   UNL     1       0.639   4.814   1.743  1.00  0.00           C  
HETATM   25  N   UNL     1      -3.799  -1.028  -0.638  1.00  0.00           N  
HETATM   26  N   UNL     1      -1.303  -1.111  -3.404  1.00  0.00           N  
HETATM   27  N   UNL     1      -5.604  -0.852   1.683  1.00  0.00           N  
HETATM   28  O   UNL     1      -3.342  -1.984  -3.410  1.00  0.00           O  
HETATM   29  O   UNL     1      -3.989   0.262   2.724  1.00  0.00           O  
HETATM   30  O   UNL     1       2.814   5.024   0.212  1.00  0.00           O  
HETATM   31  O   UNL     1       0.613   5.013  -0.918  1.00  0.00           O  
HETATM   32  O   UNL     1       1.860  -1.252  -0.518  1.00  0.00           O  
HETATM   33  F   UNL     1       6.110  -3.800   1.820  1.00  0.00           F  
HETATM   34  F   UNL     1       1.720  -2.045   2.109  1.00  0.00           F  
HETATM   35  S   UNL     1       1.462   4.593   0.141  1.00  0.00           S  
HETATM   36  H   UNL     1       3.477   2.711   0.905  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.314   2.691  -1.048  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.696   0.634   1.238  1.00  0.00           H  
HETATM   39  H   UNL     1       3.856  -3.242   3.011  1.00  0.00           H  
HETATM   40  H   UNL     1       0.624  -0.246  -3.302  1.00  0.00           H  
HETATM   41  H   UNL     1      -8.289  -0.961   1.690  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.635  -2.493   2.315  1.00  0.00           H  
HETATM   43  H   UNL     1      -8.471  -1.369   3.413  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.656  -2.585  -4.748  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.039  -1.611  -5.302  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.404  -0.908  -5.288  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.666   0.299   3.079  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.012  -1.234   3.704  1.00  0.00           H  
HETATM   49  H   UNL     1       4.122  -1.826  -1.705  1.00  0.00           H  
HETATM   50  H   UNL     1       3.648   0.273   0.635  1.00  0.00           H  
HETATM   51  H   UNL     1       6.030  -2.971  -0.652  1.00  0.00           H  
HETATM   52  H   UNL     1       0.527   5.879   1.949  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.345   4.345   1.714  1.00  0.00           H  
HETATM   54  H   UNL     1       1.239   4.353   2.527  1.00  0.00           H  
HETATM   55  H   UNL     1      -4.639  -1.468  -0.840  1.00  0.00           H  
HETATM   56  H   UNL     1      -5.909  -1.308   0.883  1.00  0.00           H  
CONECT    1   20   15   15   36                                       
CONECT    2   20   20    5   37                                       
CONECT    3   17   21   21   38                                       
CONECT    4    7    7   19   39                                       
CONECT    5    2   22    6    6                                       
CONECT    6    5    5   15   32                                       
CONECT    7   18   34    4    4                                       
CONECT    8   23   17   17   25                                       
CONECT    9   26   22   22   40                                       
CONECT   10   21   29   29   27                                       
CONECT   11   13   41   42   43                                       
CONECT   12   26   44   45   46                                       
CONECT   13   27   11   47   48                                       
CONECT   14   18   18   16   49                                       
CONECT   15    1    1    6   50                                       
CONECT   16   14   19   19   51                                       
CONECT   17   22    8    8    3                                       
CONECT   18   32   14   14    7                                       
CONECT   19   16   16    4   33                                       
CONECT   20   35    2    2    1                                       
CONECT   21   25    3    3   10                                       
CONECT   22    9    9    5   17                                       
CONECT   23   26   28   28    8                                       
CONECT   24   35   52   53   54                                       
CONECT   25    8   21   55                                            
CONECT   26   12    9   23                                            
CONECT   27   10   13   56                                            
CONECT   28   23   23                                                 
CONECT   29   10   10                                                 
CONECT   30   35   35                                                 
CONECT   31   35   35                                                 
CONECT   32    6   18                                                 
CONECT   33   19                                                      
CONECT   34    7                                                      
CONECT   35   31   31   30   30                                       
CONECT   35   24   20                                                 
CONECT   36    1                                                      
CONECT   37    2                                                      
CONECT   38    3                                                      
CONECT   39    4                                                      
CONECT   40    9                                                      
CONECT   41   11                                                      
CONECT   42   11                                                      
CONECT   43   11                                                      
CONECT   44   12                                                      
CONECT   45   12                                                      
CONECT   46   12                                                      
CONECT   47   13                                                      
CONECT   48   13                                                      
CONECT   49   14                                                      
CONECT   50   15                                                      
CONECT   51   16                                                      
CONECT   52   24                                                      
CONECT   53   24                                                      
CONECT   54   24                                                      
CONECT   55   25                                                      
CONECT   56   27                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
